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

Systemtic Name: N-[(1S,2R)-1-bromanyl-3-(4-nitrophenyl)-3-oxidanylidene-1-phenyl-propan-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1R)-1-[(S)-bromo(phenyl)methyl]-2-(4-nitrophenyl)-2-oxo-ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[(1S,2R)-1-bromo-3-(4-nitrophenyl)-3-oxo-1-phenylpropan-2-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[(1S,2R)-1-bromo-3-(4-nitrophenyl)-3-oxo-1-phenylpropan-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[(1R)-1-[(S)-bromo(phenyl)methyl]-2-keto-2-(4-nitrophenyl)ethyl]-4-methyl-benzenesulfonamide Formula: C22H19BrN2O5S MolecularWeight: 503.36566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19BrN2O5S/c1-15-7-13-19(14-8-15)31(29,30)24-21(20(23)16-5-3-2-4-6-16)22(26)17-9-11-18(12-10-17)25(27)28/h2-14,20-21,24H,1H3/t20-,21-/m0/s1