6,6'-[[10,20'-(1,3-Butadiyne-1,4-diyl)bis[5,15-bis[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]-21H,23H-porphyrin]]-10',20-diyl]bis(naphthalene-1,3-disulfonic acid diammonium) salt

化合物标识与属性

PubChem CID

102286439

SMILES

COCCOCCOCCOC1=CC=CC(=C1)/C/2=C\3/N/C(=C(\C4=[N+]=C(/C(=C/5\N/C(=C(\C6=[N+]=C2C=C6)/C7=CC8=CC(=CC(=C8C=C7)S(=O)(=O)O[NH3+])S(=O)(=O)O[NH3+])/C=C5)/C9=CC(=CC=C9)OCCOCCOCCOC)C=C4)/C#CC#C/C/1=C\2/N/C(=C(\C4=[N+]=C(/C(=C/5\N/C(=C(\C6=[N+]=C1C=C6)/C1=CC(=CC=C1)OCCOCCOCCOC)/C=C5)/C1=CC5=CC(=CC(=C5C=C1)S(=O)(=O)O[NH3+])S(=O)(=O)O[NH3+])C=C4)/C1=CC(=CC=C1)OCCOCCOCCOC)/C=C2)/C=C3

Canonical SMILES

COCCOCCOCCOc1cccc(/C2=c3\cc/c([nH]3)=C(\C#CC#C/C3=c4\cc/c([nH]4)=C(\c4cccc(OCCOCCOCCOC)c4)C4=[N+]=C(C=C4)/C(c4ccc5c(S(=O)(=O)O[NH3+])cc(S(=O)(=O)O[NH3+])cc5c4)=c4/cc/c([nH]4)=C(\c4cccc(OCCOCCOCCOC)c4)C4=[N+]=C3C=C4)C3=[N+]=C(C=C3)/C(c3cccc(OCCOCCOCCOC)c3)=c3/cc/c([nH]3)=C(\c3ccc4c(S(=O)(=O)O[NH3+])cc(S(=O)(=O)O[NH3+])cc4c3)C3=[N+]=C2C=C3)c1