[(E)-C-phenyl-N-(phenylsulfonyl)carbonimidoyl] 4-methylbenzoate

Systemtic Name: [(E)-C-phenyl-N-(phenylsulfonyl)carbonimidoyl] 4-methylbenzoate Openeye Name: [(E)-N-(benzenesulfonyl)-C-phenyl-carbonimidoyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [(E)-benzenesulfonylimino(phenyl)methyl] ester IUPAC Name: [(E)-N-(benzenesulfonyl)-C-phenylcarbonimidoyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [(E)-N-besyl-C-phenyl-carbonimidoyl] ester Formula: C21H17NO4S MolecularWeight: 379.42898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC(=NS(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)O/C(=N/S(=O)(=O)C2=CC=CC=C2)/C3=CC=CC=C3

InChI

InChI=1S/C21H17NO4S/c1-16-12-14-18(15-13-16)21(23)26-20(17-8-4-2-5-9-17)22-27(24,25)19-10-6-3-7-11-19/h2-15H,1H3/b22-20+