ethyl 4-(5-bromanyl-2-oxidanylidene-3H-benzimidazol-1-yl)-1-(cyclooctylmethyl)piperidine-3-carboxylate

Systemtic Name: ethyl 4-(5-bromanyl-2-oxidanylidene-3H-benzimidazol-1-yl)-1-(cyclooctylmethyl)piperidine-3-carboxylate Openeye Name: ethyl 4-(5-bromo-2-oxo-3H-benzimidazol-1-yl)-1-(cyclooctylmethyl)piperidine-3-carboxylate CAS Name: 4-(5-bromo-2-oxo-3H-benzimidazol-1-yl)-1-(cyclooctylmethyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(5-bromo-2-oxo-3H-benzimidazol-1-yl)-1-(cyclooctylmethyl)piperidine-3-carboxylate Traditional Name: 4-(5-bromo-2-keto-3H-benzimidazol-1-yl)-1-(cyclooctylmethyl)nipecotic acid ethyl ester Formula: C24H34BrN3O3 MolecularWeight: 492.44906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CN(CCC1N2C3=C(C=C(C=C3)Br)NC2=O)CC4CCCCCCC4

Isomeric SMILES

CCOC(=O)C1CN(CCC1N2C3=C(C=C(C=C3)Br)NC2=O)CC4CCCCCCC4

InChI

InChI=1S/C24H34BrN3O3/c1-2-31-23(29)19-16-27(15-17-8-6-4-3-5-7-9-17)13-12-21(19)28-22-11-10-18(25)14-20(22)26-24(28)30/h10-11,14,17,19,21H,2-9,12-13,15-16H2,1H3,(H,26,30)