ethyl 4-[1-(1-phenethylbenzimidazol-2-yl)piperidin-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-(1-phenethylbenzimidazol-2-yl)piperidin-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[1-(1-phenethylbenzimidazol-2-yl)piperidine-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[oxo-[1-(1-phenethyl-2-benzimidazolyl)-3-piperidinyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(1-phenethylbenzimidazol-2-yl)piperidine-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[1-(1-phenethylbenzimidazol-2-yl)nipecotoyl]piperazine-1-carboxylic acid ethyl ester Formula: C28H35N5O3 MolecularWeight: 489.6092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2CCCN(C2)C3=NC4=CC=CC=C4N3CCC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2CCCN(C2)C3=NC4=CC=CC=C4N3CCC5=CC=CC=C5

InChI

InChI=1S/C28H35N5O3/c1-2-36-28(35)31-19-17-30(18-20-31)26(34)23-11-8-15-32(21-23)27-29-24-12-6-7-13-25(24)33(27)16-14-22-9-4-3-5-10-22/h3-7,9-10,12-13,23H,2,8,11,14-21H2,1H3