methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate

Systemtic Name: methyl 4-[3-(phenylsulfonyl)propanoylamino]benzoate Openeye Name: methyl 4-[3-(benzenesulfonyl)propanoylamino]benzoate CAS Name: 4-[[3-(benzenesulfonyl)-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(benzenesulfonyl)propanoylamino]benzoate Traditional Name: 4-(3-besylpropanoylamino)benzoic acid methyl ester Formula: C17H17NO5S MolecularWeight: 347.38558

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CCS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CCS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H17NO5S/c1-23-17(20)13-7-9-14(10-8-13)18-16(19)11-12-24(21,22)15-5-3-2-4-6-15/h2-10H,11-12H2,1H3,(H,18,19)