2-methylsulfonyl-4-phenyl-butanoic acid

Systemtic Name: 2-methylsulfonyl-4-phenyl-butanoic acid Openeye Name: 2-methylsulfonyl-4-phenyl-butanoic acid CAS Name: 2-methylsulfonyl-4-phenylbutanoic acid IUPAC Name: 2-methylsulfonyl-4-phenylbutanoic acid Traditional Name: 2-mesyl-4-phenyl-butyric acid Formula: C11H14O4S MolecularWeight: 242.29146

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C(CCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CS(=O)(=O)C(CCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C11H14O4S/c1-16(14,15)10(11(12)13)8-7-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3,(H,12,13)