4-(1H-benzimidazol-2-ylcarbonyl)-3-(3,4-dichlorophenyl)-2-ethyl-2-piperidin-1-yl-3-propyl-pyrrolidine-1-carboxylic acid hydrochloride

Systemtic Name: 4-(1H-benzimidazol-2-ylcarbonyl)-3-(3,4-dichlorophenyl)-2-ethyl-2-piperidin-1-yl-3-propyl-pyrrolidine-1-carboxylic acid hydrochloride Openeye Name: 4-(1H-benzimidazole-2-carbonyl)-3-(3,4-dichlorophenyl)-2-ethyl-2-(1-piperidyl)-3-propyl-pyrrolidine-1-carboxylic acid hydrochloride CAS Name: 4-[1H-benzimidazol-2-yl(oxo)methyl]-3-(3,4-dichlorophenyl)-2-ethyl-2-(1-piperidinyl)-3-propyl-1-pyrrolidinecarboxylic acid hydrochloride IUPAC Name: 4-(1H-benzimidazole-2-carbonyl)-3-(3,4-dichlorophenyl)-2-ethyl-2-piperidin-1-yl-3-propylpyrrolidine-1-carboxylic acid hydrochloride Traditional Name: 4-(1H-benzimidazole-2-carbonyl)-3-(3,4-dichlorophenyl)-2-ethyl-2-piperidino-3-propyl-pyrrolidine-1-carboxylic acid hydrochloride Formula: C29H35Cl3N4O3 MolecularWeight: 593.9722

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(CN(C1(CC)N2CCCCC2)C(=O)O)C(=O)C3=NC4=CC=CC=C4N3)C5=CC(=C(C=C5)Cl)Cl.Cl

Isomeric SMILES

CCCC1(C(CN(C1(CC)N2CCCCC2)C(=O)O)C(=O)C3=NC4=CC=CC=C4N3)C5=CC(=C(C=C5)Cl)Cl.Cl

InChI

InChI=1S/C29H34Cl2N4O3.ClH/c1-3-14-28(19-12-13-21(30)22(31)17-19)20(25(36)26-32-23-10-6-7-11-24(23)33-26)18-35(27(37)38)29(28,4-2)34-15-8-5-9-16-34;/h6-7,10-13,17,20H,3-5,8-9,14-16,18H2,1-2H3,(H,32,33)(H,37,38);1H