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

Systemtic Name: methyl 2-(acetyloxymethyl)-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-(acetoxymethyl)-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-(acetyloxymethyl)-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-(acetyloxymethyl)-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-(acetoxymethyl)-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C13H12N2O5 MolecularWeight: 276.24478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=NC(=O)C2=C(N1)C=C(C=C2)C(=O)OC

Isomeric SMILES

CC(=O)OCC1=NC(=O)C2=C(N1)C=C(C=C2)C(=O)OC

InChI

InChI=1S/C13H12N2O5/c1-7(16)20-6-11-14-10-5-8(13(18)19-2)3-4-9(10)12(17)15-11/h3-5H,6H2,1-2H3,(H,14,15,17)