4-[2-(2-chlorophenyl)-4-oxidanylidene-quinazolin-3-yl]benzoic acid

Systemtic Name: 4-[2-(2-chlorophenyl)-4-oxidanylidene-quinazolin-3-yl]benzoic acid Openeye Name: 4-[2-(2-chlorophenyl)-4-oxo-quinazolin-3-yl]benzoic acid CAS Name: 4-[2-(2-chlorophenyl)-4-oxo-3-quinazolinyl]benzoic acid IUPAC Name: 4-[2-(2-chlorophenyl)-4-oxoquinazolin-3-yl]benzoic acid Traditional Name: 4-[2-(2-chlorophenyl)-4-keto-quinazolin-3-yl]benzoic acid Formula: C21H13ClN2O3 MolecularWeight: 376.79252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)C3=CC=CC=C3Cl)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)C3=CC=CC=C3Cl)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C21H13ClN2O3/c22-17-7-3-1-5-15(17)19-23-18-8-4-2-6-16(18)20(25)24(19)14-11-9-13(10-12-14)21(26)27/h1-12H,(H,26,27)