[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 2-chloranyl-2-fluoranyl-2-phenyl-ethanoate

Systemtic Name: [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 2-chloranyl-2-fluoranyl-2-phenyl-ethanoate Openeye Name: [17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 2-chloro-2-fluoro-2-phenyl-acetate CAS Name: 2-chloro-2-fluoro-2-phenylacetic acid [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester IUPAC Name: [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 2-chloro-2-fluoro-2-phenylacetate Traditional Name: 2-chloro-2-fluoro-2-phenyl-acetic acid [17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester Formula: C35H50ClFO2 MolecularWeight: 557.221703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C(C5=CC=CC=C5)(F)Cl)C)C

Isomeric SMILES

CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C(C5=CC=CC=C5)(F)Cl)C)C

InChI

InChI=1S/C35H50ClFO2/c1-23(2)10-9-11-24(3)29-16-17-30-28-15-14-26-22-27(18-20-33(26,4)31(28)19-21-34(29,30)5)39-32(38)35(36,37)25-12-7-6-8-13-25/h6-8,12-14,23-24,27-31H,9-11,15-22H2,1-5H3