Primary Record
HXBKZJLMJKFGSO-MEEYFZHBSA-N
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 86722450
- SMILES
- C1COC2=C(C=C3C=NN(C3=C2Br)C4=CC=C(C=C4)F)[C@]5([C@H]1C[C@](CC5)(C(F)(F)F)O)C#N.C1COC2=C(C=C3C=NN(C3=C2Br)C4=CC=C(C=C4)F)[C@@]5([C@@H]1C[C@@](CC5)(C(F)(F)F)O)C#N
- Canonical SMILES
- N#C[C@@]12CC[C@](O)(C(F)(F)F)C[C@H]1CCOc1c2cc2cnn(-c3ccc(F)cc3)c2c1Br.N#C[C@]12CC[C@@](O)(C(F)(F)F)C[C@@H]1CCOc1c2cc2cnn(-c3ccc(F)cc3)c2c1Br
Names & Synonyms
- HXBKZJLMJKFGSO-MEEYFZHBSA-N
- (3R,4aR,12bS)-8-bromo-9-(4-fluorophenyl)-3-hydroxy-3-(trifluoromethyl)-2,3,4,4a,5,6,9,12b-octahydro-1H-benzo[4,5]oxepino[3,2-f]indazole-12b-carbonitrile; compound with (3S,4aS,12bR)-8-bromo-9-(4-fluorophenyl)-3-hydroxy-3-(trifluoromethyl)-2,3,4,4a,5,6,9,12b-octahydro-1H-benzo[4,5]oxepino[3,2-f]indazole-12b-carbonitrile