1H-benzimidazol-2-ylmethyl 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate

Systemtic Name: 1H-benzimidazol-2-ylmethyl 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate Openeye Name: 1H-benzimidazol-2-ylmethyl 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate CAS Name: 2-(3-chlorophenyl)-3-methyl-4-quinolinecarboxylic acid 1H-benzimidazol-2-ylmethyl ester IUPAC Name: 1H-benzimidazol-2-ylmethyl 2-(3-chlorophenyl)-3-methylquinoline-4-carboxylate Traditional Name: 2-(3-chlorophenyl)-3-methyl-cinchoninic acid 1H-benzimidazol-2-ylmethyl ester Formula: C25H18ClN3O2 MolecularWeight: 427.88232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N=C1C3=CC(=CC=C3)Cl)C(=O)OCC4=NC5=CC=CC=C5N4

Isomeric SMILES

CC1=C(C2=CC=CC=C2N=C1C3=CC(=CC=C3)Cl)C(=O)OCC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C25H18ClN3O2/c1-15-23(25(30)31-14-22-27-20-11-4-5-12-21(20)28-22)18-9-2-3-10-19(18)29-24(15)16-7-6-8-17(26)13-16/h2-13H,14H2,1H3,(H,27,28)