methyl 3-imidazol-1-yl-4-oxidanylidene-2,3-dihydrochromene-2-carboxylate

Systemtic Name: methyl 3-imidazol-1-yl-4-oxidanylidene-2,3-dihydrochromene-2-carboxylate Openeye Name: methyl 3-imidazol-1-yl-4-oxo-chromane-2-carboxylate CAS Name: 3-(1-imidazolyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid methyl ester IUPAC Name: methyl 3-imidazol-1-yl-4-oxo-2,3-dihydrochromene-2-carboxylate Traditional Name: 3-imidazol-1-yl-4-keto-chroman-2-carboxylic acid methyl ester Formula: C14H12N2O4 MolecularWeight: 272.25608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C(=O)C2=CC=CC=C2O1)N3C=CN=C3

Isomeric SMILES

COC(=O)C1C(C(=O)C2=CC=CC=C2O1)N3C=CN=C3

InChI

InChI=1S/C14H12N2O4/c1-19-14(18)13-11(16-7-6-15-8-16)12(17)9-4-2-3-5-10(9)20-13/h2-8,11,13H,1H3