2-[(4-oxidanylidenecinnolin-1-yl)methyl]benzoic acid

Systemtic Name: 2-[(4-oxidanylidenecinnolin-1-yl)methyl]benzoic acid Openeye Name: 2-[(4-oxocinnolin-1-yl)methyl]benzoic acid CAS Name: 2-[(4-oxo-1-cinnolinyl)methyl]benzoic acid IUPAC Name: 2-[(4-oxocinnolin-1-yl)methyl]benzoic acid Traditional Name: 2-[(4-ketocinnolin-1-yl)methyl]benzoic acid Formula: C16H12N2O3 MolecularWeight: 280.27808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C3=CC=CC=C3C(=O)C=N2)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)CN2C3=CC=CC=C3C(=O)C=N2)C(=O)O

InChI

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