2-[(3-chloranyl-2-fluoranyl-phenyl)sulfonylamino]-3-methyl-pentanoic acid

Systemtic Name: 2-[(3-chloranyl-2-fluoranyl-phenyl)sulfonylamino]-3-methyl-pentanoic acid Openeye Name: 2-[(3-chloro-2-fluoro-phenyl)sulfonylamino]-3-methyl-pentanoic acid CAS Name: 2-[(3-chloro-2-fluorophenyl)sulfonylamino]-3-methylpentanoic acid IUPAC Name: 2-[(3-chloro-2-fluorophenyl)sulfonylamino]-3-methylpentanoic acid Traditional Name: 2-[(3-chloro-2-fluoro-phenyl)sulfonylamino]-3-methyl-valeric acid Formula: C12H15ClFNO4S MolecularWeight: 323.768203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NS(=O)(=O)C1=C(C(=CC=C1)Cl)F

Isomeric SMILES

CCC(C)C(C(=O)O)NS(=O)(=O)C1=C(C(=CC=C1)Cl)F

InChI

InChI=1S/C12H15ClFNO4S/c1-3-7(2)11(12(16)17)15-20(18,19)9-6-4-5-8(13)10(9)14/h4-7,11,15H,3H2,1-2H3,(H,16,17)