methyl 4-(5-oxidanylidene-3-pyridin-4-yl-1,2-oxazol-2-yl)benzoate

Systemtic Name: methyl 4-(5-oxidanylidene-3-pyridin-4-yl-1,2-oxazol-2-yl)benzoate Openeye Name: methyl 4-[5-oxo-3-(4-pyridyl)isoxazol-2-yl]benzoate CAS Name: 4-(5-oxo-3-pyridin-4-yl-2-isoxazolyl)benzoic acid methyl ester IUPAC Name: methyl 4-(5-oxo-3-pyridin-4-yl-1,2-oxazol-2-yl)benzoate Traditional Name: 4-[5-keto-3-(4-pyridyl)-3-isoxazolin-2-yl]benzoic acid methyl ester Formula: C16H12N2O4 MolecularWeight: 296.27748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)N2C(=CC(=O)O2)C3=CC=NC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N2C(=CC(=O)O2)C3=CC=NC=C3

InChI

InChI=1S/C16H12N2O4/c1-21-16(20)12-2-4-13(5-3-12)18-14(10-15(19)22-18)11-6-8-17-9-7-11/h2-10H,1H3