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

Systemtic Name: propan-2-yl 3-[2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfonylethanoylamino]benzoate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 3-[[2-[2-(4-chloroanilino)-2-oxoethyl]sulfonylacetyl]amino]benzoate Traditional Name: 3-[[2-[2-(4-chloroanilino)-2-keto-ethyl]sulfonylacetyl]amino]benzoic acid isopropyl ester Formula: C20H21ClN2O6S MolecularWeight: 452.90854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN2O6S/c1-13(2)29-20(26)14-4-3-5-17(10-14)23-19(25)12-30(27,28)11-18(24)22-16-8-6-15(21)7-9-16/h3-10,13H,11-12H2,1-2H3,(H,22,24)(H,23,25)