[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl] 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoate

Systemtic Name: [2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl] 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoate Openeye Name: [2-(2-methylanilino)-2-oxo-ethyl] 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoate CAS Name: 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoic acid [2-(2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylanilino)-2-oxoethyl] 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoate Traditional Name: 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoic acid [2-keto-2-(o-toluidino)ethyl] ester Formula: C27H30N2O5S MolecularWeight: 494.6025

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)COC(=O)C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)COC(=O)C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C27H30N2O5S/c1-19-7-5-6-8-24(19)29-25(30)18-34-26(31)21-11-9-20(10-12-21)17-28-35(32,33)23-15-13-22(14-16-23)27(2,3)4/h5-16,28H,17-18H2,1-4H3,(H,29,30)