methyl 2-[4-[1-(4-cyanobutyl)benzimidazol-2-yl]carbonylpiperidin-1-yl]-2-methoxy-propanoate

Systemtic Name: methyl 2-[4-[1-(4-cyanobutyl)benzimidazol-2-yl]carbonylpiperidin-1-yl]-2-methoxy-propanoate Openeye Name: methyl 2-[4-[1-(4-cyanobutyl)benzimidazole-2-carbonyl]-1-piperidyl]-2-methoxy-propanoate CAS Name: 2-[4-[[1-(4-cyanobutyl)-2-benzimidazolyl]-oxomethyl]-1-piperidinyl]-2-methoxypropanoic acid methyl ester IUPAC Name: methyl 2-[4-[1-(4-cyanobutyl)benzimidazole-2-carbonyl]piperidin-1-yl]-2-methoxypropanoate Traditional Name: 2-[4-[1-(4-cyanobutyl)benzimidazole-2-carbonyl]piperidino]-2-methoxy-propionic acid methyl ester Formula: C23H30N4O4 MolecularWeight: 426.5087

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)(N1CCC(CC1)C(=O)C2=NC3=CC=CC=C3N2CCCCC#N)OC

Isomeric SMILES

CC(C(=O)OC)(N1CCC(CC1)C(=O)C2=NC3=CC=CC=C3N2CCCCC#N)OC

InChI

InChI=1S/C23H30N4O4/c1-23(31-3,22(29)30-2)26-15-11-17(12-16-26)20(28)21-25-18-9-5-6-10-19(18)27(21)14-8-4-7-13-24/h5-6,9-10,17H,4,7-8,11-12,14-16H2,1-3H3