2-[1-(cyclooctylmethyl)-4-(3-ethyl-2-oxidanylidene-benzimidazol-1-yl)piperidin-3-yl]ethanenitrile

Systemtic Name: 2-[1-(cyclooctylmethyl)-4-(3-ethyl-2-oxidanylidene-benzimidazol-1-yl)piperidin-3-yl]ethanenitrile Openeye Name: 2-[1-(cyclooctylmethyl)-4-(3-ethyl-2-oxo-benzimidazol-1-yl)-3-piperidyl]acetonitrile CAS Name: 2-[1-(cyclooctylmethyl)-4-(3-ethyl-2-oxo-1-benzimidazolyl)-3-piperidinyl]acetonitrile IUPAC Name: 2-[1-(cyclooctylmethyl)-4-(3-ethyl-2-oxobenzimidazol-1-yl)piperidin-3-yl]acetonitrile Traditional Name: 2-[1-(cyclooctylmethyl)-4-(3-ethyl-2-keto-benzimidazol-1-yl)-3-piperidyl]acetonitrile Formula: C25H36N4O MolecularWeight: 408.57954

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N(C1=O)C3CCN(CC3CC#N)CC4CCCCCCC4

Isomeric SMILES

CCN1C2=CC=CC=C2N(C1=O)C3CCN(CC3CC#N)CC4CCCCCCC4

InChI

InChI=1S/C25H36N4O/c1-2-28-23-12-8-9-13-24(23)29(25(28)30)22-15-17-27(19-21(22)14-16-26)18-20-10-6-4-3-5-7-11-20/h8-9,12-13,20-22H,2-7,10-11,14-15,17-19H2,1H3