1-[(3Z)-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)-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)-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)-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)-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)-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: C35H41F3N2O2 MolecularWeight: 578.70745

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1(CCC2C1(CC(C3=C4CCC(=NO)C=C4CCC23)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=C4CCC23)C5=CC=C(C=C5)N6CCCCC6)C)C#CC(F)(F)F

InChI

InChI=1S/C35H41F3N2O2/c1-3-31(41)34(17-18-35(36,37)38)16-15-30-28-13-9-24-21-25(39-42)10-14-27(24)32(28)29(22-33(30,34)2)23-7-11-26(12-8-23)40-19-5-4-6-20-40/h7-8,11-12,21,28-30,42H,3-6,9-10,13-16,19-20,22H2,1-2H3/b39-25-