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

Systemtic Name: 1-[(3Z)-3-hydroxyimino-6,13-dimethyl-11-(4-morpholin-4-ylphenyl)-17-(3-oxidanylprop-1-ynyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethanone Openeye Name: 1-[(3Z)-3-hydroxyimino-17-(3-hydroxyprop-1-ynyl)-6,13-dimethyl-11-(4-morpholinophenyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethanone CAS Name: 1-[(3Z)-3-hydroxyimino-17-(3-hydroxyprop-1-ynyl)-6,13-dimethyl-11-[4-(4-morpholinyl)phenyl]-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethanone IUPAC Name: 1-[(3Z)-3-hydroxyimino-17-(3-hydroxyprop-1-ynyl)-6,13-dimethyl-11-(4-morpholin-4-ylphenyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethanone Traditional Name: 1-[(3Z)-3-hydroximino-17-(3-hydroxyprop-1-ynyl)-6,13-dimethyl-11-(4-morpholinophenyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethanone Formula: C34H42N2O4 MolecularWeight: 542.70828

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2C3CCC(C3(CC(C2=C4C1=CC(=NO)CC4)C5=CC=C(C=C5)N6CCOCC6)C)(C#CCO)C(=O)C

Isomeric SMILES

CC1CC2C3CCC(C3(CC(C2=C4C1=C/C(=N\O)/CC4)C5=CC=C(C=C5)N6CCOCC6)C)(C#CCO)C(=O)C

InChI

InChI=1S/C34H42N2O4/c1-22-19-29-31-11-13-34(23(2)38,12-4-16-37)33(31,3)21-30(32(29)27-10-7-25(35-39)20-28(22)27)24-5-8-26(9-6-24)36-14-17-40-18-15-36/h5-6,8-9,20,22,29-31,37,39H,7,10-11,13-19,21H2,1-3H3/b35-25-