ethyl 1-(cyclononylmethyl)-4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidine-3-carboxylate

Systemtic Name: ethyl 1-(cyclononylmethyl)-4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidine-3-carboxylate Openeye Name: ethyl 1-(cyclononylmethyl)-4-(2-oxo-3H-benzimidazol-1-yl)piperidine-3-carboxylate CAS Name: 1-(cyclononylmethyl)-4-(2-oxo-3H-benzimidazol-1-yl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(cyclononylmethyl)-4-(2-oxo-3H-benzimidazol-1-yl)piperidine-3-carboxylate Traditional Name: 1-(cyclononylmethyl)-4-(2-keto-3H-benzimidazol-1-yl)nipecotic acid ethyl ester Formula: C25H37N3O3 MolecularWeight: 427.57958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CN(CCC1N2C3=CC=CC=C3NC2=O)CC4CCCCCCCC4

Isomeric SMILES

CCOC(=O)C1CN(CCC1N2C3=CC=CC=C3NC2=O)CC4CCCCCCCC4

InChI

InChI=1S/C25H37N3O3/c1-2-31-24(29)20-18-27(17-19-11-7-5-3-4-6-8-12-19)16-15-22(20)28-23-14-10-9-13-21(23)26-25(28)30/h9-10,13-14,19-20,22H,2-8,11-12,15-18H2,1H3,(H,26,30)