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

Systemtic Name: [2-[(3Z)-3-hydroxyimino-6,13-dimethyl-17-prop-1-ynyl-11-(4-pyrrolidin-1-ylphenyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxidanylidene-ethyl] ethanoate Openeye Name: [2-[(3Z)-3-hydroxyimino-6,13-dimethyl-17-prop-1-ynyl-11-(4-pyrrolidin-1-ylphenyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxo-ethyl] acetate CAS Name: acetic acid [2-[(3Z)-3-hydroxyimino-6,13-dimethyl-17-prop-1-ynyl-11-[4-(1-pyrrolidinyl)phenyl]-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] ester IUPAC Name: [2-[(3Z)-3-hydroxyimino-6,13-dimethyl-17-prop-1-ynyl-11-(4-pyrrolidin-1-ylphenyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate Traditional Name: acetic acid [2-[(3Z)-3-hydroximino-6,13-dimethyl-17-prop-1-ynyl-11-(4-pyrrolidinophenyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-keto-ethyl] ester Formula: C36H44N2O4 MolecularWeight: 568.74556

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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)N6CCCC6)C)C(=O)COC(=O)C

Isomeric SMILES

CC#CC1(CCC2C1(CC(C3=C4CC/C(=N/O)/C=C4C(CC23)C)C5=CC=C(C=C5)N6CCCC6)C)C(=O)COC(=O)C

InChI

InChI=1S/C36H44N2O4/c1-5-15-36(33(40)22-42-24(3)39)16-14-32-30-19-23(2)29-20-26(37-41)10-13-28(29)34(30)31(21-35(32,36)4)25-8-11-27(12-9-25)38-17-6-7-18-38/h8-9,11-12,20,23,30-32,41H,6-7,10,13-14,16-19,21-22H2,1-4H3/b37-26-