Chemical Compound

3-{3-[6,16-bis(2,3,4,5,6-pentafluorophenyl)-20,21,22,23-tetraazapentacyclo[15.2.1.12,5.17,10.112,15]tricosa-1(19),2,4,6,8,10,12(21),13,15,17-decaen-11-yl]phenyl}-10-(2-{4-[7,12,17-tris(2,4,6-trimethylphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]phenyl}ethynyl)-3-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-2,4-dione

3-{3-[6,16-bis(2,3,4,5,6-pentafluorophenyl)-20,21,22,23-tetraazapentacyclo[15.2.1.12,5.17,10.112,15]tricosa-1(19),2,4,6,8,10,12(21),13,15,17-decaen-11-yl]phenyl}-10-(2-{4-[7,12,17-tris(2,4,6-trimethylphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]phenyl}ethynyl)-3-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-2,4-dione 结构式
Primary record

3-{3-[6,16-bis(2,3,4,5,6-pentafluorophenyl)-20,21,22,23-tetraazapentacyclo[15.2.1.12,5.17,10.112,15]tricosa-1(19),2,4,6,8,10,12(21),13,15,17-decaen-11-yl]phenyl}-10-(2-{4-[7,12,17-tris(2,4,6-trimethylphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]phenyl}ethynyl)-3-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-2,4-dione

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
102201216
SMILES
CC1=CC(=C(C(=C1)C)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=C(C=C(C=C7C)C)C)C8=C(C=C(C=C8C)C)C)C=C4)C9=CC=C(C=C9)C#CC1=C2C=CC=C4C2=C(C=C1)C(=O)N(C4=O)C1=CC=CC(=C1)C1=C2C=CC(=N2)C(=C2C=CC(=C4C=CC(=C(C5=CC=C1N5)C1=C(C(=C(C(=C1F)F)F)F)F)N4)N2)C1=C(C(=C(C(=C1F)F)F)F)F)N3)C
Canonical SMILES
Cc1cc(C)c(-c2c3nc(c(-c4c(C)cc(C)cc4C)c4ccc([nH]4)c(-c4c(C)cc(C)cc4C)c4nc(c(-c5ccc(C#Cc6ccc7c8c(cccc68)C(=O)N(c6cccc(-c8c9nc(c(-c%10c(F)c(F)c(F)c(F)c%10F)c%10ccc([nH]%10)c%10ccc([nH]%10)c(-c%10c(F)c(F)c(F)c(F)c%10F)c%10ccc8[nH]%10)C=C9)c6)C7=O)cc5)c5ccc2[nH]5)C=C4)C=C3)c(C)c1

名称与同义词

  • J3.176.776H
  • 2-[3-[5,15-Bis(pentafluorophenyl)-22-dehydro-24-hydrocorrole-10-yl]phenyl]-6-[[4-(5,15,20-trimesityl-21H,23H-porphyrin-10-yl)phenyl]ethynyl]-2H-benzo[de]isoquinoline-1,3-dione
  • 3-{3-[6,16-bis(2,3,4,5,6-pentafluorophenyl)-20,21,22,23-tetraazapentacyclo[15.2.1.12,5.17,10.112,15]tricosa-1(19),2,4,6,8,10,12(21),13,15,17-decaen-11-yl]phenyl}-10-(2-{4-[7,12,17-tris(2,4,6-trimethylphenyl)-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]phenyl}ethynyl)-3-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-2,4-dione