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

Systemtic Name: butyl 4-[2-(4-methylphenyl)sulfonylethanoylamino]benzoate Openeye Name: butyl 4-[[2-(p-tolylsulfonyl)acetyl]amino]benzoate CAS Name: 4-[[2-(4-methylphenyl)sulfonyl-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-(4-methylphenyl)sulfonylacetyl]amino]benzoate Traditional Name: 4-[(2-tosylacetyl)amino]benzoic acid butyl ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C20H23NO5S/c1-3-4-13-26-20(23)16-7-9-17(10-8-16)21-19(22)14-27(24,25)18-11-5-15(2)6-12-18/h5-12H,3-4,13-14H2,1-2H3,(H,21,22)