3-[(4-oxidanylidenequinazolin-3-yl)methyl]benzoate

Systemtic Name: 3-[(4-oxidanylidenequinazolin-3-yl)methyl]benzoate Openeye Name: 3-[(4-oxoquinazolin-3-yl)methyl]benzoate CAS Name: 3-[(4-oxo-3-quinazolinyl)methyl]benzoate IUPAC Name: 3-[(4-oxoquinazolin-3-yl)methyl]benzoate Traditional Name: 3-[(4-ketoquinazolin-3-yl)methyl]benzoate Formula: C16H11N2O3- MolecularWeight: 279.27014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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