1-[(3Z)-3-hydroxyimino-6,13-dimethyl-11-(4-piperidin-1-ylphenyl)-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-methoxy-ethanone

Systemtic Name: 1-[(3Z)-3-hydroxyimino-6,13-dimethyl-11-(4-piperidin-1-ylphenyl)-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-methoxy-ethanone Openeye Name: 1-[(3Z)-3-hydroxyimino-6,13-dimethyl-11-[4-(1-piperidyl)phenyl]-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-methoxy-ethanone CAS Name: 1-[(3Z)-3-hydroxyimino-6,13-dimethyl-11-[4-(1-piperidinyl)phenyl]-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-methoxyethanone IUPAC Name: 1-[(3Z)-3-hydroxyimino-6,13-dimethyl-11-(4-piperidin-1-ylphenyl)-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-methoxyethanone Traditional Name: 1-[(3Z)-3-hydroximino-6,13-dimethyl-11-(4-piperidinophenyl)-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-methoxy-ethanone Formula: C36H46N2O3 MolecularWeight: 554.76204

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1(CCC2C1(CC(C3=C4CCC(=NO)C=C4C(CC23)C)C5=CC=C(C=C5)N6CCCCC6)C)C(=O)COC

Isomeric SMILES

CC#CC1(CCC2C1(CC(C3=C4CC/C(=N/O)/C=C4C(CC23)C)C5=CC=C(C=C5)N6CCCCC6)C)C(=O)COC

InChI

InChI=1S/C36H46N2O3/c1-5-16-36(33(39)23-41-4)17-15-32-30-20-24(2)29-21-26(37-40)11-14-28(29)34(30)31(22-35(32,36)3)25-9-12-27(13-10-25)38-18-7-6-8-19-38/h9-10,12-13,21,24,30-32,40H,6-8,11,14-15,17-20,22-23H2,1-4H3/b37-26-