(2S,3R,5S)-2-[(1S)-1-[(3S,6aR,11aS,11bR)-10,11b-dimethyl-3-oxidanyl-1,2,3,4,6,6a,11,11a-octahydrobenzo[a]fluoren-9-yl]ethyl]-1-butyl-5-methyl-piperidin-3-ol hydrochloride

Systemtic Name: (2S,3R,5S)-2-[(1S)-1-[(3S,6aR,11aS,11bR)-10,11b-dimethyl-3-oxidanyl-1,2,3,4,6,6a,11,11a-octahydrobenzo[a]fluoren-9-yl]ethyl]-1-butyl-5-methyl-piperidin-3-ol hydrochloride Openeye Name: (2S,3R,5S)-2-[(1S)-1-[(3S,6aR,11aS,11bR)-3-hydroxy-10,11b-dimethyl-1,2,3,4,6,6a,11,11a-octahydrobenzo[a]fluoren-9-yl]ethyl]-1-butyl-5-methyl-piperidin-3-ol hydrochloride CAS Name: (2S,3R,5S)-2-[(1S)-1-[(3S,6aR,11aS,11bR)-3-hydroxy-10,11b-dimethyl-1,2,3,4,6,6a,11,11a-octahydrobenzo[a]fluoren-9-yl]ethyl]-1-butyl-5-methyl-3-piperidinol hydrochloride IUPAC Name: (2S,3R,5S)-2-[(1S)-1-[(3S,6aR,11aS,11bR)-3-hydroxy-10,11b-dimethyl-1,2,3,4,6,6a,11,11a-octahydrobenzo[a]fluoren-9-yl]ethyl]-1-butyl-5-methylpiperidin-3-ol hydrochloride Traditional Name: (2S,3R,5S)-2-[(1S)-1-[(3S,6aR,11aS,11bR)-3-hydroxy-10,11b-dimethyl-1,2,3,4,6,6a,11,11a-octahydrobenzo[a]fluoren-9-yl]ethyl]-1-butyl-5-methyl-piperidin-3-ol hydrochloride Formula: C31H48ClNO2 MolecularWeight: 502.17132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC(CC(C1C(C)C2=C(C3=C(C=C2)C4CC=C5CC(CCC5(C4C3)C)O)C)O)C.Cl

Isomeric SMILES

CCCCN1C[C@H](C[C@H]([C@@H]1[C@@H](C)C2=C(C3=C(C=C2)[C@@H]4CC=C5C[C@H](CC[C@@]5([C@H]4C3)C)O)C)O)C.Cl

InChI

InChI=1S/C31H47NO2.ClH/c1-6-7-14-32-18-19(2)15-29(34)30(32)21(4)24-10-11-25-26-9-8-22-16-23(33)12-13-31(22,5)28(26)17-27(25)20(24)3;/h8,10-11,19,21,23,26,28-30,33-34H,6-7,9,12-18H2,1-5H3;1H/t19-,21-,23-,26-,28-,29+,30-,31-;/m0./s1