4-[(4-oxidanylidenequinazolin-3-yl)methyl]benzoic acid

Systemtic Name: 4-[(4-oxidanylidenequinazolin-3-yl)methyl]benzoic acid Openeye Name: 4-[(4-oxoquinazolin-3-yl)methyl]benzoic acid CAS Name: 4-[(4-oxo-3-quinazolinyl)methyl]benzoic acid IUPAC Name: 4-[(4-oxoquinazolin-3-yl)methyl]benzoic acid Traditional Name: 4-[(4-ketoquinazolin-3-yl)methyl]benzoic acid Formula: C16H12N2O3 MolecularWeight: 280.27808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H12N2O3/c19-15-13-3-1-2-4-14(13)17-10-18(15)9-11-5-7-12(8-6-11)16(20)21/h1-8,10H,9H2,(H,20,21)