[1-[(4-ethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoate

Systemtic Name: [1-[(4-ethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoate Openeye Name: [2-(4-ethylanilino)-1-methyl-2-oxo-ethyl] 2-[methyl(p-tolylsulfonyl)amino]acetate CAS Name: 2-[methyl-(4-methylphenyl)sulfonylamino]acetic acid [1-(4-ethylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-ethylanilino)-1-oxopropan-2-yl] 2-[methyl-(4-methylphenyl)sulfonylamino]acetate Traditional Name: 2-[methyl(tosyl)amino]acetic acid [2-(4-ethylanilino)-2-keto-1-methyl-ethyl] ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)OC(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C(C)OC(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H26N2O5S/c1-5-17-8-10-18(11-9-17)22-21(25)16(3)28-20(24)14-23(4)29(26,27)19-12-6-15(2)7-13-19/h6-13,16H,5,14H2,1-4H3,(H,22,25)