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

Systemtic Name: 2-[(3-methyl-1,2-oxazol-5-yl)carbonylamino]-4-methylsulfonyl-butanoic acid Openeye Name: 2-[(3-methylisoxazole-5-carbonyl)amino]-4-methylsulfonyl-butanoic acid CAS Name: 2-[[(3-methyl-5-isoxazolyl)-oxomethyl]amino]-4-methylsulfonylbutanoic acid IUPAC Name: 2-[(3-methyl-1,2-oxazole-5-carbonyl)amino]-4-methylsulfonylbutanoic acid Traditional Name: 4-mesyl-2-[(3-methylisoxazole-5-carbonyl)amino]butyric acid Formula: C10H14N2O6S MolecularWeight: 290.29296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C(=O)NC(CCS(=O)(=O)C)C(=O)O

Isomeric SMILES

CC1=NOC(=C1)C(=O)NC(CCS(=O)(=O)C)C(=O)O

InChI

InChI=1S/C10H14N2O6S/c1-6-5-8(18-12-6)9(13)11-7(10(14)15)3-4-19(2,16)17/h5,7H,3-4H2,1-2H3,(H,11,13)(H,14,15)