N-[(1R,2S)-1-chloranyl-3-(4-fluorophenyl)-3-oxidanylidene-1-phenyl-propan-2-yl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[(1R,2S)-1-chloranyl-3-(4-fluorophenyl)-3-oxidanylidene-1-phenyl-propan-2-yl]-2-nitro-benzenesulfonamide Openeye Name: N-[(1S)-1-[(R)-chloro(phenyl)methyl]-2-(4-fluorophenyl)-2-oxo-ethyl]-2-nitro-benzenesulfonamide CAS Name: N-[(1R,2S)-1-chloro-3-(4-fluorophenyl)-3-oxo-1-phenylpropan-2-yl]-2-nitrobenzenesulfonamide IUPAC Name: N-[(1R,2S)-1-chloro-3-(4-fluorophenyl)-3-oxo-1-phenylpropan-2-yl]-2-nitrobenzenesulfonamide Traditional Name: N-[(1S)-1-[(R)-chloro(phenyl)methyl]-2-(4-fluorophenyl)-2-keto-ethyl]-2-nitro-benzenesulfonamide Formula: C21H16ClFN2O5S MolecularWeight: 462.878543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C(=O)C2=CC=C(C=C2)F)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)[C@H]([C@H](C(=O)C2=CC=C(C=C2)F)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])Cl

InChI

InChI=1S/C21H16ClFN2O5S/c22-19(14-6-2-1-3-7-14)20(21(26)15-10-12-16(23)13-11-15)24-31(29,30)18-9-5-4-8-17(18)25(27)28/h1-13,19-20,24H/t19-,20-/m1/s1