methyl 4-[[3-(1H-benzimidazol-2-ylcarbonyl)-3-(3,4-dimethoxyphenyl)-2-ethyl-2-piperidin-1-yl-pyrrolidin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[3-(1H-benzimidazol-2-ylcarbonyl)-3-(3,4-dimethoxyphenyl)-2-ethyl-2-piperidin-1-yl-pyrrolidin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[3-(1H-benzimidazole-2-carbonyl)-3-(3,4-dimethoxyphenyl)-2-ethyl-2-(1-piperidyl)pyrrolidin-1-yl]methyl]benzoate CAS Name: 4-[[3-[1H-benzimidazol-2-yl(oxo)methyl]-3-(3,4-dimethoxyphenyl)-2-ethyl-2-(1-piperidinyl)-1-pyrrolidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(1H-benzimidazole-2-carbonyl)-3-(3,4-dimethoxyphenyl)-2-ethyl-2-piperidin-1-ylpyrrolidin-1-yl]methyl]benzoate Traditional Name: 4-[[3-(1H-benzimidazole-2-carbonyl)-3-(3,4-dimethoxyphenyl)-2-ethyl-2-piperidino-pyrrolidino]methyl]benzoic acid methyl ester Formula: C36H42N4O5 MolecularWeight: 610.74248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(CCN1CC2=CC=C(C=C2)C(=O)OC)(C3=CC(=C(C=C3)OC)OC)C(=O)C4=NC5=CC=CC=C5N4)N6CCCCC6

Isomeric SMILES

CCC1(C(CCN1CC2=CC=C(C=C2)C(=O)OC)(C3=CC(=C(C=C3)OC)OC)C(=O)C4=NC5=CC=CC=C5N4)N6CCCCC6

InChI

InChI=1S/C36H42N4O5/c1-5-36(39-20-9-6-10-21-39)35(27-17-18-30(43-2)31(23-27)44-3,32(41)33-37-28-11-7-8-12-29(28)38-33)19-22-40(36)24-25-13-15-26(16-14-25)34(42)45-4/h7-8,11-18,23H,5-6,9-10,19-22,24H2,1-4H3,(H,37,38)