methyl 4-[2-(4-methylphenyl)sulfonylethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(4-methylphenyl)sulfonylethanoylamino]benzoate Openeye Name: methyl 4-[[2-(p-tolylsulfonyl)acetyl]amino]benzoate CAS Name: 4-[[2-(4-methylphenyl)sulfonyl-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-methylphenyl)sulfonylacetyl]amino]benzoate Traditional Name: 4-[(2-tosylacetyl)amino]benzoic acid methyl ester Formula: C17H17NO5S MolecularWeight: 347.38558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C17H17NO5S/c1-12-3-9-15(10-4-12)24(21,22)11-16(19)18-14-7-5-13(6-8-14)17(20)23-2/h3-10H,11H2,1-2H3,(H,18,19)