2-[(2-chloranyl-6-fluoranyl-phenyl)carbonylamino]-4-methylsulfonyl-butanoic acid

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)carbonylamino]-4-methylsulfonyl-butanoic acid Openeye Name: 2-[(2-chloro-6-fluoro-benzoyl)amino]-4-methylsulfonyl-butanoic acid CAS Name: 2-[[(2-chloro-6-fluorophenyl)-oxomethyl]amino]-4-methylsulfonylbutanoic acid IUPAC Name: 2-[(2-chloro-6-fluorobenzoyl)amino]-4-methylsulfonylbutanoic acid Traditional Name: 2-[(2-chloro-6-fluoro-benzoyl)amino]-4-mesyl-butyric acid Formula: C12H13ClFNO5S MolecularWeight: 337.751723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)O)NC(=O)C1=C(C=CC=C1Cl)F

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)O)NC(=O)C1=C(C=CC=C1Cl)F

InChI

InChI=1S/C12H13ClFNO5S/c1-21(19,20)6-5-9(12(17)18)15-11(16)10-7(13)3-2-4-8(10)14/h2-4,9H,5-6H2,1H3,(H,15,16)(H,17,18)