2-[(2-methoxy-5-methyl-phenyl)methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: 2-[(2-methoxy-5-methyl-phenyl)methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: 2-[(2-methoxy-5-methyl-phenyl)methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[(2-methoxy-5-methylphenyl)methyl]-4-oxo-1H-quinazoline-7-carboxylate IUPAC Name: 2-[(2-methoxy-5-methylphenyl)methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-(2-methoxy-5-methyl-benzyl)-1H-quinazoline-7-carboxylate Formula: C18H15N2O4- MolecularWeight: 323.3227

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C18H16N2O4/c1-10-3-6-15(24-2)12(7-10)9-16-19-14-8-11(18(22)23)4-5-13(14)17(21)20-16/h3-8H,9H2,1-2H3,(H,22,23)(H,19,20,21)/p-1