2-[(3,4-dichlorophenyl)methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylic acid

Systemtic Name: 2-[(3,4-dichlorophenyl)methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylic acid Openeye Name: 2-[(3,4-dichlorophenyl)methyl]-4-oxo-1H-quinazoline-7-carboxylic acid CAS Name: 2-[(3,4-dichlorophenyl)methyl]-4-oxo-1H-quinazoline-7-carboxylic acid IUPAC Name: 2-[(3,4-dichlorophenyl)methyl]-4-oxo-1H-quinazoline-7-carboxylic acid Traditional Name: 2-(3,4-dichlorobenzyl)-4-keto-1H-quinazoline-7-carboxylic acid Formula: C16H10Cl2N2O3 MolecularWeight: 349.1682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)O)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)O)Cl)Cl

InChI

InChI=1S/C16H10Cl2N2O3/c17-11-4-1-8(5-12(11)18)6-14-19-13-7-9(16(22)23)2-3-10(13)15(21)20-14/h1-5,7H,6H2,(H,22,23)(H,19,20,21)