[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl] 3-[(4-propan-2-ylphenyl)sulfonylamino]propanoate

Systemtic Name: [2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl] 3-[(4-propan-2-ylphenyl)sulfonylamino]propanoate Openeye Name: [2-(4-methylanilino)-2-oxo-ethyl] 3-[(4-isopropylphenyl)sulfonylamino]propanoate CAS Name: 3-[(4-propan-2-ylphenyl)sulfonylamino]propanoic acid [2-(4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methylanilino)-2-oxoethyl] 3-[(4-propan-2-ylphenyl)sulfonylamino]propanoate Traditional Name: 3-(p-cumenylsulfonylamino)propionic acid [2-keto-2-(p-toluidino)ethyl] ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)COC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)COC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C21H26N2O5S/c1-15(2)17-6-10-19(11-7-17)29(26,27)22-13-12-21(25)28-14-20(24)23-18-8-4-16(3)5-9-18/h4-11,15,22H,12-14H2,1-3H3,(H,23,24)