methyl 4-oxidanylidene-2-(pyridin-2-ylmethyl)-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 4-oxidanylidene-2-(pyridin-2-ylmethyl)-1H-quinazoline-7-carboxylate Openeye Name: methyl 4-oxo-2-(2-pyridylmethyl)-1H-quinazoline-7-carboxylate CAS Name: 4-oxo-2-(2-pyridinylmethyl)-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 4-oxo-2-(pyridin-2-ylmethyl)-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-(2-pyridylmethyl)-1H-quinazoline-7-carboxylic acid methyl ester Formula: C16H13N3O3 MolecularWeight: 295.29272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CC3=CC=CC=N3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CC3=CC=CC=N3

InChI

InChI=1S/C16H13N3O3/c1-22-16(21)10-5-6-12-13(8-10)18-14(19-15(12)20)9-11-4-2-3-7-17-11/h2-8H,9H2,1H3,(H,18,19,20)