methyl 2-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]benzoate

Systemtic Name: methyl 2-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]benzoate Openeye Name: methyl 2-[isobutyl(p-tolylsulfonyl)amino]benzoate CAS Name: 2-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]benzoate Traditional Name: 2-[isobutyl(tosyl)amino]benzoic acid methyl ester Formula: C19H23NO4S MolecularWeight: 361.45522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(C)C)C2=CC=CC=C2C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(C)C)C2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C19H23NO4S/c1-14(2)13-20(18-8-6-5-7-17(18)19(21)24-4)25(22,23)16-11-9-15(3)10-12-16/h5-12,14H,13H2,1-4H3