ethyl 1-[3-(benzimidazol-1-yl)propanoyl]-4-phenethyl-piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-(benzimidazol-1-yl)propanoyl]-4-phenethyl-piperidine-4-carboxylate Openeye Name: ethyl 1-[3-(benzimidazol-1-yl)propanoyl]-4-phenethyl-piperidine-4-carboxylate CAS Name: 1-[3-(1-benzimidazolyl)-1-oxopropyl]-4-phenethyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(benzimidazol-1-yl)propanoyl]-4-phenethylpiperidine-4-carboxylate Traditional Name: 1-[3-(benzimidazol-1-yl)propanoyl]-4-phenethyl-isonipecotic acid ethyl ester Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)CCN2C=NC3=CC=CC=C32)CCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)CCN2C=NC3=CC=CC=C32)CCC4=CC=CC=C4

InChI

InChI=1S/C26H31N3O3/c1-2-32-25(31)26(14-12-21-8-4-3-5-9-21)15-18-28(19-16-26)24(30)13-17-29-20-27-22-10-6-7-11-23(22)29/h3-11,20H,2,12-19H2,1H3