2-benzamido-4-methylsulfonyl-butanoic acid

Systemtic Name: 2-benzamido-4-methylsulfonyl-butanoic acid Openeye Name: 2-benzamido-4-methylsulfonyl-butanoic acid CAS Name: 2-benzamido-4-methylsulfonylbutanoic acid IUPAC Name: 2-benzamido-4-methylsulfonylbutanoic acid Traditional Name: 2-benzamido-4-mesyl-butyric acid Formula: C12H15NO5S MolecularWeight: 285.3162

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)O)NC(=O)C1=CC=CC=C1

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)O)NC(=O)C1=CC=CC=C1

InChI

InChI=1S/C12H15NO5S/c1-19(17,18)8-7-10(12(15)16)13-11(14)9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3,(H,13,14)(H,15,16)