ethyl 4-[3-(1H-benzimidazol-2-ylcarbonyl)-3-(3,4-dichlorophenyl)-2-ethyl-2-piperidin-1-yl-piperidin-1-yl]butanoate

Systemtic Name: ethyl 4-[3-(1H-benzimidazol-2-ylcarbonyl)-3-(3,4-dichlorophenyl)-2-ethyl-2-piperidin-1-yl-piperidin-1-yl]butanoate Openeye Name: ethyl 4-[3-(1H-benzimidazole-2-carbonyl)-3-(3,4-dichlorophenyl)-2-ethyl-2-(1-piperidyl)-1-piperidyl]butanoate CAS Name: 4-[3-[1H-benzimidazol-2-yl(oxo)methyl]-3-(3,4-dichlorophenyl)-2-ethyl-2-(1-piperidinyl)-1-piperidinyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[3-(1H-benzimidazole-2-carbonyl)-3-(3,4-dichlorophenyl)-2-ethyl-2-piperidin-1-ylpiperidin-1-yl]butanoate Traditional Name: 4-[3-(1H-benzimidazole-2-carbonyl)-3-(3,4-dichlorophenyl)-2-ethyl-2-piperidino-piperidino]butyric acid ethyl ester Formula: C32H40Cl2N4O3 MolecularWeight: 599.591

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(CCCN1CCCC(=O)OCC)(C2=CC(=C(C=C2)Cl)Cl)C(=O)C3=NC4=CC=CC=C4N3)N5CCCCC5

Isomeric SMILES

CCC1(C(CCCN1CCCC(=O)OCC)(C2=CC(=C(C=C2)Cl)Cl)C(=O)C3=NC4=CC=CC=C4N3)N5CCCCC5

InChI

InChI=1S/C32H40Cl2N4O3/c1-3-32(37-18-8-5-9-19-37)31(23-15-16-24(33)25(34)22-23,17-11-21-38(32)20-10-14-28(39)41-4-2)29(40)30-35-26-12-6-7-13-27(26)36-30/h6-7,12-13,15-16,22H,3-5,8-11,14,17-21H2,1-2H3,(H,35,36)