ethyl 1-[3-(pyridin-3-ylmethoxymethyl)phenyl]benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-[3-(pyridin-3-ylmethoxymethyl)phenyl]benzimidazole-5-carboxylate Openeye Name: ethyl 1-[3-(3-pyridylmethoxymethyl)phenyl]benzimidazole-5-carboxylate CAS Name: 1-[3-(3-pyridinylmethoxymethyl)phenyl]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(pyridin-3-ylmethoxymethyl)phenyl]benzimidazole-5-carboxylate Traditional Name: 1-[3-(3-pyridylmethoxymethyl)phenyl]benzimidazole-5-carboxylic acid ethyl ester Formula: C23H21N3O3 MolecularWeight: 387.43114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C=N2)C3=CC=CC(=C3)COCC4=CN=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C=N2)C3=CC=CC(=C3)COCC4=CN=CC=C4

InChI

InChI=1S/C23H21N3O3/c1-2-29-23(27)19-8-9-22-21(12-19)25-16-26(22)20-7-3-5-17(11-20)14-28-15-18-6-4-10-24-13-18/h3-13,16H,2,14-15H2,1H3