ethyl 1-[(1-methylbenzimidazol-2-yl)methyl]-4-(3-phenylpropyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(1-methylbenzimidazol-2-yl)methyl]-4-(3-phenylpropyl)piperidine-4-carboxylate Openeye Name: ethyl 1-[(1-methylbenzimidazol-2-yl)methyl]-4-(3-phenylpropyl)piperidine-4-carboxylate CAS Name: 1-[(1-methyl-2-benzimidazolyl)methyl]-4-(3-phenylpropyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(1-methylbenzimidazol-2-yl)methyl]-4-(3-phenylpropyl)piperidine-4-carboxylate Traditional Name: 1-[(1-methylbenzimidazol-2-yl)methyl]-4-(3-phenylpropyl)isonipecotic acid ethyl ester Formula: C26H33N3O2 MolecularWeight: 419.55912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC2=NC3=CC=CC=C3N2C)CCCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC2=NC3=CC=CC=C3N2C)CCCC4=CC=CC=C4

InChI

InChI=1S/C26H33N3O2/c1-3-31-25(30)26(15-9-12-21-10-5-4-6-11-21)16-18-29(19-17-26)20-24-27-22-13-7-8-14-23(22)28(24)2/h4-8,10-11,13-14H,3,9,12,15-20H2,1-2H3