N-[(1R,2R)-2-bromanyl-1-(4-methoxyphenyl)-3-(4-nitrophenyl)-3-oxidanylidene-propyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(1R,2R)-2-bromanyl-1-(4-methoxyphenyl)-3-(4-nitrophenyl)-3-oxidanylidene-propyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1R,2R)-2-bromo-1-(4-methoxyphenyl)-3-(4-nitrophenyl)-3-oxo-propyl]-4-methyl-benzenesulfonamide CAS Name: N-[(1R,2R)-2-bromo-1-(4-methoxyphenyl)-3-(4-nitrophenyl)-3-oxopropyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(1R,2R)-2-bromo-1-(4-methoxyphenyl)-3-(4-nitrophenyl)-3-oxopropyl]-4-methylbenzenesulfonamide Traditional Name: N-[(1R,2R)-2-bromo-3-keto-1-(4-methoxyphenyl)-3-(4-nitrophenyl)propyl]-4-methyl-benzenesulfonamide Formula: C23H21BrN2O6S MolecularWeight: 533.39164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21BrN2O6S/c1-15-3-13-20(14-4-15)33(30,31)25-22(16-7-11-19(32-2)12-8-16)21(24)23(27)17-5-9-18(10-6-17)26(28)29/h3-14,21-22,25H,1-2H3/t21-,22-/m1/s1