2-(4-acetamidophenyl)-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: 2-(4-acetamidophenyl)-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: 2-(4-acetamidophenyl)-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-(4-acetamidophenyl)-4-oxo-1H-quinazoline-7-carboxylate IUPAC Name: 2-(4-acetamidophenyl)-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-(4-acetamidophenyl)-4-keto-1H-quinazoline-7-carboxylate Formula: C17H12N3O4- MolecularWeight: 322.29488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C17H13N3O4/c1-9(21)18-12-5-2-10(3-6-12)15-19-14-8-11(17(23)24)4-7-13(14)16(22)20-15/h2-8H,1H3,(H,18,21)(H,23,24)(H,19,20,22)/p-1