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

Systemtic Name: 4-[(2-oxidanylidenequinoxalin-1-yl)methyl]benzoic acid Openeye Name: 4-[(2-oxoquinoxalin-1-yl)methyl]benzoic acid CAS Name: 4-[(2-oxo-1-quinoxalinyl)methyl]benzoic acid IUPAC Name: 4-[(2-oxoquinoxalin-1-yl)methyl]benzoic acid Traditional Name: 4-[(2-ketoquinoxalin-1-yl)methyl]benzoic acid Formula: C16H12N2O3 MolecularWeight: 280.27808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CC(=O)N2CC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=CC(=O)N2CC3=CC=C(C=C3)C(=O)O

InChI

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