ethyl (3S)-1-(1-phenacylbenzimidazol-2-yl)piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-(1-phenacylbenzimidazol-2-yl)piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-(1-phenacylbenzimidazol-2-yl)piperidine-3-carboxylate CAS Name: (3S)-1-(1-phenacyl-2-benzimidazolyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-(1-phenacylbenzimidazol-2-yl)piperidine-3-carboxylate Traditional Name: (3S)-1-(1-phenacylbenzimidazol-2-yl)nipecotic acid ethyl ester Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2=NC3=CC=CC=C3N2CC(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C2=NC3=CC=CC=C3N2CC(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3O3/c1-2-29-22(28)18-11-8-14-25(15-18)23-24-19-12-6-7-13-20(19)26(23)16-21(27)17-9-4-3-5-10-17/h3-7,9-10,12-13,18H,2,8,11,14-16H2,1H3/t18-/m0/s1