methyl 4-[2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfonylethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfonylethanoylamino]benzoate Openeye Name: methyl 4-[[2-(2-anilino-2-oxo-ethyl)sulfonylacetyl]amino]benzoate CAS Name: 4-[[2-(2-anilino-2-oxoethyl)sulfonyl-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(2-anilino-2-oxoethyl)sulfonylacetyl]amino]benzoate Traditional Name: 4-[[2-(2-anilino-2-keto-ethyl)sulfonylacetyl]amino]benzoic acid methyl ester Formula: C18H18N2O6S MolecularWeight: 390.41032

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CS(=O)(=O)CC(=O)NC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CS(=O)(=O)CC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C18H18N2O6S/c1-26-18(23)13-7-9-15(10-8-13)20-17(22)12-27(24,25)11-16(21)19-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,19,21)(H,20,22)