4-[[(3-methyl-1,2-oxazol-5-yl)carbonylamino]methyl]benzoate

Systemtic Name: 4-[[(3-methyl-1,2-oxazol-5-yl)carbonylamino]methyl]benzoate Openeye Name: 4-[[(3-methylisoxazole-5-carbonyl)amino]methyl]benzoate CAS Name: 4-[[[(3-methyl-5-isoxazolyl)-oxomethyl]amino]methyl]benzoate IUPAC Name: 4-[[(3-methyl-1,2-oxazole-5-carbonyl)amino]methyl]benzoate Traditional Name: 4-[[(3-methylisoxazole-5-carbonyl)amino]methyl]benzoate Formula: C13H11N2O4- MolecularWeight: 259.23744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C(=O)NCC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

CC1=NOC(=C1)C(=O)NCC2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C13H12N2O4/c1-8-6-11(19-15-8)12(16)14-7-9-2-4-10(5-3-9)13(17)18/h2-6H,7H2,1H3,(H,14,16)(H,17,18)/p-1