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

Systemtic Name: ethyl 4-[3-(1H-benzimidazol-2-ylcarbonyl)-3-(3,4-dichlorophenyl)-2-ethyl-2-piperidin-1-yl-pyrrolidin-1-yl]butanoate Openeye Name: ethyl 4-[3-(1H-benzimidazole-2-carbonyl)-3-(3,4-dichlorophenyl)-2-ethyl-2-(1-piperidyl)pyrrolidin-1-yl]butanoate CAS Name: 4-[3-[1H-benzimidazol-2-yl(oxo)methyl]-3-(3,4-dichlorophenyl)-2-ethyl-2-(1-piperidinyl)-1-pyrrolidinyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[3-(1H-benzimidazole-2-carbonyl)-3-(3,4-dichlorophenyl)-2-ethyl-2-piperidin-1-ylpyrrolidin-1-yl]butanoate Traditional Name: 4-[3-(1H-benzimidazole-2-carbonyl)-3-(3,4-dichlorophenyl)-2-ethyl-2-piperidino-pyrrolidino]butyric acid ethyl ester Formula: C31H38Cl2N4O3 MolecularWeight: 585.56442

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(CCN1CCCC(=O)OCC)(C2=CC(=C(C=C2)Cl)Cl)C(=O)C3=NC4=CC=CC=C4N3)N5CCCCC5

Isomeric SMILES

CCC1(C(CCN1CCCC(=O)OCC)(C2=CC(=C(C=C2)Cl)Cl)C(=O)C3=NC4=CC=CC=C4N3)N5CCCCC5

InChI

InChI=1S/C31H38Cl2N4O3/c1-3-31(36-17-8-5-9-18-36)30(22-14-15-23(32)24(33)21-22,16-20-37(31)19-10-13-27(38)40-4-2)28(39)29-34-25-11-6-7-12-26(25)35-29/h6-7,11-12,14-15,21H,3-5,8-10,13,16-20H2,1-2H3,(H,34,35)