[(13S)-2-[bis(fluoranyl)methyl]-13-methyl-17-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] sulfamate

Systemtic Name: [(13S)-2-[bis(fluoranyl)methyl]-13-methyl-17-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] sulfamate Openeye Name: [(13S)-2-(difluoromethyl)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] sulfamate CAS Name: sulfamic acid [(13S)-2-(difluoromethyl)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ester IUPAC Name: [(13S)-2-(difluoromethyl)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] sulfamate Traditional Name: sulfamic acid [(13S)-2-(difluoromethyl)-17-keto-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ester Formula: C19H23F2NO4S MolecularWeight: 399.452026

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1CCC2=O)CCC4=CC(=C(C=C34)C(F)F)OS(=O)(=O)N

Isomeric SMILES

C[C@]12CCC3C(C1CCC2=O)CCC4=CC(=C(C=C34)C(F)F)OS(=O)(=O)N

InChI

InChI=1S/C19H23F2NO4S/c1-19-7-6-11-12(15(19)4-5-17(19)23)3-2-10-8-16(26-27(22,24)25)14(18(20)21)9-13(10)11/h8-9,11-12,15,18H,2-7H2,1H3,(H2,22,24,25)/t11?,12?,15?,19-/m0/s1