N-(1-cyanocyclohexyl)-N-methyl-2-[4-(phenylcarbonyl)piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(1-cyanocyclohexyl)-N-methyl-2-[4-(phenylcarbonyl)piperidin-1-ium-1-yl]ethanamide Openeye Name: 2-(4-benzoylpiperidin-1-ium-1-yl)-N-(1-cyanocyclohexyl)-N-methyl-acetamide CAS Name: 2-(4-benzoyl-1-piperidin-1-iumyl)-N-(1-cyanocyclohexyl)-N-methylacetamide IUPAC Name: 2-(4-benzoylpiperidin-1-ium-1-yl)-N-(1-cyanocyclohexyl)-N-methylacetamide Traditional Name: 2-(4-benzoylpiperidin-1-ium-1-yl)-N-(1-cyanocyclohexyl)-N-methyl-acetamide Formula: C22H30N3O2+ MolecularWeight: 368.4925

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)C[NH+]1CCC(CC1)C(=O)C2=CC=CC=C2)C3(CCCCC3)C#N

Isomeric SMILES

CN(C(=O)C[NH+]1CCC(CC1)C(=O)C2=CC=CC=C2)C3(CCCCC3)C#N

InChI

InChI=1S/C22H29N3O2/c1-24(22(17-23)12-6-3-7-13-22)20(26)16-25-14-10-19(11-15-25)21(27)18-8-4-2-5-9-18/h2,4-5,8-9,19H,3,6-7,10-16H2,1H3/p+1