[(4-methylphenyl)-(phenylsulfonyl)amino]methyl benzoate

Systemtic Name: [(4-methylphenyl)-(phenylsulfonyl)amino]methyl benzoate Openeye Name: [N-(benzenesulfonyl)-4-methyl-anilino]methyl benzoate CAS Name: benzoic acid [N-(benzenesulfonyl)-4-methylanilino]methyl ester IUPAC Name: [N-(benzenesulfonyl)-4-methylanilino]methyl benzoate Traditional Name: benzoic acid (N-besyl-4-methyl-anilino)methyl ester Formula: C21H19NO4S MolecularWeight: 381.44486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19NO4S/c1-17-12-14-19(15-13-17)22(27(24,25)20-10-6-3-7-11-20)16-26-21(23)18-8-4-2-5-9-18/h2-15H,16H2,1H3