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

Systemtic Name: N-[(1R,2S)-1-chloranyl-3-oxidanylidene-1,3-diphenyl-propan-2-yl]-2-nitro-benzenesulfonamide Openeye Name: N-[(1S,2R)-1-benzoyl-2-chloro-2-phenyl-ethyl]-2-nitro-benzenesulfonamide CAS Name: N-[(1R,2S)-1-chloro-3-oxo-1,3-diphenylpropan-2-yl]-2-nitrobenzenesulfonamide IUPAC Name: N-[(1R,2S)-1-chloro-3-oxo-1,3-diphenylpropan-2-yl]-2-nitrobenzenesulfonamide Traditional Name: N-[(1S,2R)-1-benzoyl-2-chloro-2-phenyl-ethyl]-2-nitro-benzenesulfonamide Formula: C21H17ClN2O5S MolecularWeight: 444.88808

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C21H17ClN2O5S/c22-19(15-9-3-1-4-10-15)20(21(25)16-11-5-2-6-12-16)23-30(28,29)18-14-8-7-13-17(18)24(26)27/h1-14,19-20,23H/t19-,20-/m1/s1