4-(benzamidocarbamoyl)-2-nitro-3-(phenylmethyl)benzenesulfonamide

Systemtic Name: 4-(benzamidocarbamoyl)-2-nitro-3-(phenylmethyl)benzenesulfonamide Openeye Name: 4-(benzamidocarbamoyl)-3-benzyl-2-nitro-benzenesulfonamide CAS Name: 4-[(benzoylhydrazo)-oxomethyl]-2-nitro-3-(phenylmethyl)benzenesulfonamide IUPAC Name: 4-(benzamidocarbamoyl)-3-benzyl-2-nitrobenzenesulfonamide Traditional Name: 4-(benzamidocarbamoyl)-3-benzyl-2-nitro-benzenesulfonamide Formula: C21H18N4O6S MolecularWeight: 454.45582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(C=CC(=C2[N+](=O)[O-])S(=O)(=O)N)C(=O)NNC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(C=CC(=C2[N+](=O)[O-])S(=O)(=O)N)C(=O)NNC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H18N4O6S/c22-32(30,31)18-12-11-16(21(27)24-23-20(26)15-9-5-2-6-10-15)17(19(18)25(28)29)13-14-7-3-1-4-8-14/h1-12H,13H2,(H,23,26)(H,24,27)(H2,22,30,31)