3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl quinoline-2-carboxylate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl quinoline-2-carboxylate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl quinoline-2-carboxylate Traditional Name: quinaldic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C20H17N3O3 MolecularWeight: 347.36728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C(=O)OCCCN3C4=CC=CC=C4NC3=O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C(=O)OCCCN3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C20H17N3O3/c24-19(17-11-10-14-6-1-2-7-15(14)21-17)26-13-5-12-23-18-9-4-3-8-16(18)22-20(23)25/h1-4,6-11H,5,12-13H2,(H,22,25)