[4-[(E)-[(4-methylphenyl)sulfonylhydrazinylidene]methyl]-2-nitro-phenyl] benzoate

Systemtic Name: [4-[(E)-[(4-methylphenyl)sulfonylhydrazinylidene]methyl]-2-nitro-phenyl] benzoate Openeye Name: [2-nitro-4-[(E)-(p-tolylsulfonylhydrazono)methyl]phenyl] benzoate CAS Name: benzoic acid [4-[(E)-[(4-methylphenyl)sulfonylhydrazinylidene]methyl]-2-nitrophenyl] ester IUPAC Name: [4-[(E)-[(4-methylphenyl)sulfonylhydrazinylidene]methyl]-2-nitrophenyl] benzoate Traditional Name: benzoic acid [2-nitro-4-[(E)-(tosylhydrazono)methyl]phenyl] ester Formula: C21H17N3O6S MolecularWeight: 439.44118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NN=CC2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H17N3O6S/c1-15-7-10-18(11-8-15)31(28,29)23-22-14-16-9-12-20(19(13-16)24(26)27)30-21(25)17-5-3-2-4-6-17/h2-14,23H,1H3/b22-14+