11-(4-dimethylaminophenyl)-13-methyl-17-oxidanyl-17-prop-2-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one

Systemtic Name: 11-(4-dimethylaminophenyl)-13-methyl-17-oxidanyl-17-prop-2-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one Openeye Name: 11-(4-dimethylaminophenyl)-17-hydroxy-13-methyl-17-prop-2-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one CAS Name: 11-(4-dimethylaminophenyl)-17-hydroxy-13-methyl-17-prop-2-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one IUPAC Name: 11-(4-dimethylaminophenyl)-17-hydroxy-13-methyl-17-prop-2-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one Traditional Name: 11-(4-dimethylaminophenyl)-17-hydroxy-13-methyl-17-propargyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one Formula: C29H35NO2 MolecularWeight: 429.5937

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC(C3=C4CCC(=O)C=C4CCC3C1CCC2(CC#C)O)C5=CC=C(C=C5)N(C)C

Isomeric SMILES

CC12CC(C3=C4CCC(=O)C=C4CCC3C1CCC2(CC#C)O)C5=CC=C(C=C5)N(C)C

InChI

InChI=1S/C29H35NO2/c1-5-15-29(32)16-14-26-24-12-8-20-17-22(31)11-13-23(20)27(24)25(18-28(26,29)2)19-6-9-21(10-7-19)30(3)4/h1,6-7,9-10,17,24-26,32H,8,11-16,18H2,2-4H3