2-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]ethanamide

Systemtic Name: 2-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]ethanamide Openeye Name: 2-[4-(2-oxopyrrolidin-1-yl)phenyl]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]acetamide CAS Name: 2-[4-(2-oxo-1-pyrrolidinyl)phenyl]-N-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]acetamide IUPAC Name: 2-[4-(2-oxopyrrolidin-1-yl)phenyl]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]acetamide Traditional Name: 2-[4-(2-ketopyrrolidino)phenyl]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]acetamide Formula: C24H36N3O2+ MolecularWeight: 398.56154

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)CC2=CC=C(C=C2)N3CCCC3=O)[NH+]4CCCCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)CC2=CC=C(C=C2)N3CCCC3=O)[NH+]4CCCCC4

InChI

InChI=1S/C24H35N3O2/c28-22(18-20-9-11-21(12-10-20)27-17-7-8-23(27)29)25-19-24(13-3-1-4-14-24)26-15-5-2-6-16-26/h9-12H,1-8,13-19H2,(H,25,28)/p+1