ethyl 1-[1-[1-(cyclohexylmethyl)benzimidazol-2-yl]piperidin-4-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-[1-(cyclohexylmethyl)benzimidazol-2-yl]piperidin-4-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[1-[1-(cyclohexylmethyl)benzimidazol-2-yl]piperidine-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[1-[1-(cyclohexylmethyl)-2-benzimidazolyl]-4-piperidinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-[1-(cyclohexylmethyl)benzimidazol-2-yl]piperidine-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[1-[1-(cyclohexylmethyl)benzimidazol-2-yl]isonipecotoyl]nipecotic acid ethyl ester Formula: C28H40N4O3 MolecularWeight: 480.6422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2CCN(CC2)C3=NC4=CC=CC=C4N3CC5CCCCC5

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2CCN(CC2)C3=NC4=CC=CC=C4N3CC5CCCCC5

InChI

InChI=1S/C28H40N4O3/c1-2-35-27(34)23-11-8-16-31(20-23)26(33)22-14-17-30(18-15-22)28-29-24-12-6-7-13-25(24)32(28)19-21-9-4-3-5-10-21/h6-7,12-13,21-23H,2-5,8-11,14-20H2,1H3