2-[(3,5-dimethyl-1,2-oxazol-4-yl)carbonylamino]-4-methylsulfonyl-butanoic acid

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)carbonylamino]-4-methylsulfonyl-butanoic acid Openeye Name: 2-[(3,5-dimethylisoxazole-4-carbonyl)amino]-4-methylsulfonyl-butanoic acid CAS Name: 2-[[(3,5-dimethyl-4-isoxazolyl)-oxomethyl]amino]-4-methylsulfonylbutanoic acid IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazole-4-carbonyl)amino]-4-methylsulfonylbutanoic acid Traditional Name: 2-[(3,5-dimethylisoxazole-4-carbonyl)amino]-4-mesyl-butyric acid Formula: C11H16N2O6S MolecularWeight: 304.31954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)NC(CCS(=O)(=O)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)NC(CCS(=O)(=O)C)C(=O)O

InChI

InChI=1S/C11H16N2O6S/c1-6-9(7(2)19-13-6)10(14)12-8(11(15)16)4-5-20(3,17)18/h8H,4-5H2,1-3H3,(H,12,14)(H,15,16)