methyl 2-[2-(4-methylphenyl)ethanoyloxymethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[2-(4-methylphenyl)ethanoyloxymethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 4-oxo-2-[[2-(p-tolyl)acetyl]oxymethyl]-1H-quinazoline-7-carboxylate CAS Name: 2-[[2-(4-methylphenyl)-1-oxoethoxy]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(4-methylphenyl)acetyl]oxymethyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-[[2-(p-tolyl)acetyl]oxymethyl]-1H-quinazoline-7-carboxylic acid methyl ester Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(=O)OCC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)CC(=O)OCC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H18N2O5/c1-12-3-5-13(6-4-12)9-18(23)27-11-17-21-16-10-14(20(25)26-2)7-8-15(16)19(24)22-17/h3-8,10H,9,11H2,1-2H3,(H,21,22,24)