[2-[(3Z)-6-fluoranyl-3-hydroxyimino-13-methyl-11-(4-pyrrolidin-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]-2-oxidanylidene-ethyl] ethanoate

Systemtic Name: [2-[(3Z)-6-fluoranyl-3-hydroxyimino-13-methyl-11-(4-pyrrolidin-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]-2-oxidanylidene-ethyl] ethanoate Openeye Name: [2-[(3Z)-6-fluoro-3-hydroxyimino-13-methyl-11-(4-pyrrolidin-1-ylphenyl)-17-(3,3,3-trifluoroprop-1-ynyl)-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)-6-fluoro-3-hydroxyimino-13-methyl-11-[4-(1-pyrrolidinyl)phenyl]-17-(3,3,3-trifluoroprop-1-ynyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] ester IUPAC Name: [2-[(3Z)-6-fluoro-3-hydroxyimino-13-methyl-11-(4-pyrrolidin-1-ylphenyl)-17-(3,3,3-trifluoroprop-1-ynyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate Traditional Name: acetic acid [2-[(3Z)-6-fluoro-3-hydroximino-13-methyl-11-(4-pyrrolidinophenyl)-17-(3,3,3-trifluoroprop-1-ynyl)-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-keto-ethyl] ester Formula: C35H38F4N2O4 MolecularWeight: 626.680833

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(=O)C1(CCC2C1(CC(C3=C4CCC(=NO)C=C4C(CC23)F)C5=CC=C(C=C5)N6CCCC6)C)C#CC(F)(F)F

Isomeric SMILES

CC(=O)OCC(=O)C1(CCC2C1(CC(C3=C4CC/C(=N/O)/C=C4C(CC23)F)C5=CC=C(C=C5)N6CCCC6)C)C#CC(F)(F)F

InChI

InChI=1S/C35H38F4N2O4/c1-21(42)45-20-31(43)34(13-14-35(37,38)39)12-11-29-27-18-30(36)26-17-23(40-44)7-10-25(26)32(27)28(19-33(29,34)2)22-5-8-24(9-6-22)41-15-3-4-16-41/h5-6,8-9,17,27-30,44H,3-4,7,10-12,15-16,18-20H2,1-2H3/b40-23-