(2S,3S)-3-methyl-2-[(3-methyl-1,2-oxazol-5-yl)carbonylamino]pentanoate

Systemtic Name: (2S,3S)-3-methyl-2-[(3-methyl-1,2-oxazol-5-yl)carbonylamino]pentanoate Openeye Name: (2S,3S)-3-methyl-2-[(3-methylisoxazole-5-carbonyl)amino]pentanoate CAS Name: (2S,3S)-3-methyl-2-[[(3-methyl-5-isoxazolyl)-oxomethyl]amino]pentanoate IUPAC Name: (2S,3S)-3-methyl-2-[(3-methyl-1,2-oxazole-5-carbonyl)amino]pentanoate Traditional Name: (2S,3S)-3-methyl-2-[(3-methylisoxazole-5-carbonyl)amino]valerate Formula: C11H15N2O4- MolecularWeight: 239.2478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)C1=CC(=NO1)C

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)[O-])NC(=O)C1=CC(=NO1)C

InChI

InChI=1S/C11H16N2O4/c1-4-6(2)9(11(15)16)12-10(14)8-5-7(3)13-17-8/h5-6,9H,4H2,1-3H3,(H,12,14)(H,15,16)/p-1/t6-,9-/m0/s1