ethyl 1-[1-[1-(3-methylbutyl)benzimidazol-2-yl]piperidin-3-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-[1-(3-methylbutyl)benzimidazol-2-yl]piperidin-3-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[1-(1-isopentylbenzimidazol-2-yl)piperidine-3-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[1-[1-(3-methylbutyl)-2-benzimidazolyl]-3-piperidinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-[1-(3-methylbutyl)benzimidazol-2-yl]piperidine-3-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[1-(1-isoamylbenzimidazol-2-yl)nipecotoyl]nipecotic acid ethyl ester Formula: C26H38N4O3 MolecularWeight: 454.60492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2CCCN(C2)C3=NC4=CC=CC=C4N3CCC(C)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2CCCN(C2)C3=NC4=CC=CC=C4N3CCC(C)C

InChI

InChI=1S/C26H38N4O3/c1-4-33-25(32)21-10-8-14-28(18-21)24(31)20-9-7-15-29(17-20)26-27-22-11-5-6-12-23(22)30(26)16-13-19(2)3/h5-6,11-12,19-21H,4,7-10,13-18H2,1-3H3