N-[(1S,2R)-1-bromanyl-3-(4-chlorophenyl)-1-(4-nitrophenyl)-3-oxidanylidene-propan-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(1S,2R)-1-bromanyl-3-(4-chlorophenyl)-1-(4-nitrophenyl)-3-oxidanylidene-propan-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1R)-1-[(S)-bromo-(4-nitrophenyl)methyl]-2-(4-chlorophenyl)-2-oxo-ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[(1S,2R)-1-bromo-3-(4-chlorophenyl)-1-(4-nitrophenyl)-3-oxopropan-2-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[(1S,2R)-1-bromo-3-(4-chlorophenyl)-1-(4-nitrophenyl)-3-oxopropan-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[(1R)-1-[(S)-bromo-(4-nitrophenyl)methyl]-2-(4-chlorophenyl)-2-keto-ethyl]-4-methyl-benzenesulfonamide Formula: C22H18BrClN2O5S MolecularWeight: 537.81072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C2=CC=C(C=C2)[N+](=O)[O-])Br)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H]([C@H](C2=CC=C(C=C2)[N+](=O)[O-])Br)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H18BrClN2O5S/c1-14-2-12-19(13-3-14)32(30,31)25-21(22(27)16-4-8-17(24)9-5-16)20(23)15-6-10-18(11-7-15)26(28)29/h2-13,20-21,25H,1H3/t20-,21-/m0/s1