2-[(3-methoxy-4-methyl-phenyl)methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: 2-[(3-methoxy-4-methyl-phenyl)methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: 2-[(3-methoxy-4-methyl-phenyl)methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[(3-methoxy-4-methylphenyl)methyl]-4-oxo-1H-quinazoline-7-carboxylate IUPAC Name: 2-[(3-methoxy-4-methylphenyl)methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-(3-methoxy-4-methyl-benzyl)-1H-quinazoline-7-carboxylate Formula: C18H15N2O4- MolecularWeight: 323.3227

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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