11-[2-(4-dimethylaminophenyl)ethynyl]-13-methyl-17-oxidanyl-17-prop-1-ynyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one

Systemtic Name: 11-[2-(4-dimethylaminophenyl)ethynyl]-13-methyl-17-oxidanyl-17-prop-1-ynyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one Openeye Name: 11-[2-(4-dimethylaminophenyl)ethynyl]-17-hydroxy-13-methyl-17-prop-1-ynyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one CAS Name: 11-[2-(4-dimethylaminophenyl)ethynyl]-17-hydroxy-13-methyl-17-prop-1-ynyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one IUPAC Name: 11-[2-(4-dimethylaminophenyl)ethynyl]-17-hydroxy-13-methyl-17-prop-1-ynyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one Traditional Name: 11-[2-(4-dimethylaminophenyl)ethynyl]-17-hydroxy-13-methyl-17-prop-1-ynyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one Formula: C31H37NO2 MolecularWeight: 455.63098

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1(CCC2C1(CC(C3C2CCC4=CC(=O)CCC34)C#CC5=CC=C(C=C5)N(C)C)C)O

Isomeric SMILES

CC#CC1(CCC2C1(CC(C3C2CCC4=CC(=O)CCC34)C#CC5=CC=C(C=C5)N(C)C)C)O

InChI

InChI=1S/C31H37NO2/c1-5-17-31(34)18-16-28-27-14-10-22-19-25(33)13-15-26(22)29(27)23(20-30(28,31)2)9-6-21-7-11-24(12-8-21)32(3)4/h7-8,11-12,19,23,26-29,34H,10,13-16,18,20H2,1-4H3