ethyl 3-[2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfonylethanoylamino]benzoate

Systemtic Name: ethyl 3-[2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfonylethanoylamino]benzoate Openeye Name: ethyl 3-[[2-[2-(4-chloroanilino)-2-oxo-ethyl]sulfonylacetyl]amino]benzoate CAS Name: 3-[[2-[2-(4-chloroanilino)-2-oxoethyl]sulfonyl-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[2-(4-chloroanilino)-2-oxoethyl]sulfonylacetyl]amino]benzoate Traditional Name: 3-[[2-[2-(4-chloroanilino)-2-keto-ethyl]sulfonylacetyl]amino]benzoic acid ethyl ester Formula: C19H19ClN2O6S MolecularWeight: 438.88196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CS(=O)(=O)CC(=O)NC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CS(=O)(=O)CC(=O)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H19ClN2O6S/c1-2-28-19(25)13-4-3-5-16(10-13)22-18(24)12-29(26,27)11-17(23)21-15-8-6-14(20)7-9-15/h3-10H,2,11-12H2,1H3,(H,21,23)(H,22,24)