1-[(3Z)-6-fluoranyl-3-hydroxyimino-13-methyl-11-(4-piperidin-1-ylphenyl)-17-[3,3,3-tris(fluoranyl)prop-1-ynyl]-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]propan-1-one

Systemtic Name: 1-[(3Z)-6-fluoranyl-3-hydroxyimino-13-methyl-11-(4-piperidin-1-ylphenyl)-17-[3,3,3-tris(fluoranyl)prop-1-ynyl]-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]propan-1-one Openeye Name: 1-[(3Z)-6-fluoro-3-hydroxyimino-13-methyl-11-[4-(1-piperidyl)phenyl]-17-(3,3,3-trifluoroprop-1-ynyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]propan-1-one CAS Name: 1-[(3Z)-6-fluoro-3-hydroxyimino-13-methyl-11-[4-(1-piperidinyl)phenyl]-17-(3,3,3-trifluoroprop-1-ynyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-1-propanone IUPAC Name: 1-[(3Z)-6-fluoro-3-hydroxyimino-13-methyl-11-(4-piperidin-1-ylphenyl)-17-(3,3,3-trifluoroprop-1-ynyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]propan-1-one Traditional Name: 1-[(3Z)-6-fluoro-3-hydroximino-13-methyl-11-(4-piperidinophenyl)-17-(3,3,3-trifluoroprop-1-ynyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]propan-1-one Formula: C35H40F4N2O2 MolecularWeight: 596.697913

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1(CCC2C1(CC(C3=C4CCC(=NO)C=C4C(CC23)F)C5=CC=C(C=C5)N6CCCCC6)C)C#CC(F)(F)F

Isomeric SMILES

CCC(=O)C1(CCC2C1(CC(C3=C4CC/C(=N/O)/C=C4C(CC23)F)C5=CC=C(C=C5)N6CCCCC6)C)C#CC(F)(F)F

InChI

InChI=1S/C35H40F4N2O2/c1-3-31(42)34(15-16-35(37,38)39)14-13-29-27-20-30(36)26-19-23(40-43)9-12-25(26)32(27)28(21-33(29,34)2)22-7-10-24(11-8-22)41-17-5-4-6-18-41/h7-8,10-11,19,27-30,43H,3-6,9,12-14,17-18,20-21H2,1-2H3/b40-23-