N1-phenyl-N4-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]piperidine-1,4-dicarboxamide

Systemtic Name: N1-phenyl-N4-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]piperidine-1,4-dicarboxamide Openeye Name: N1-phenyl-N4-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]piperidine-1,4-dicarboxamide CAS Name: N1-phenyl-N4-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]piperidine-1,4-dicarboxamide IUPAC Name: 1-N-phenyl-4-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]piperidine-1,4-dicarboxamide Traditional Name: N-phenyl-N'-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]piperidine-1,4-dicarboxamide Formula: C25H39N4O2+ MolecularWeight: 427.60276

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)C2CCN(CC2)C(=O)NC3=CC=CC=C3)[NH+]4CCCCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)C2CCN(CC2)C(=O)NC3=CC=CC=C3)[NH+]4CCCCC4

InChI

InChI=1S/C25H38N4O2/c30-23(26-20-25(14-6-2-7-15-25)29-16-8-3-9-17-29)21-12-18-28(19-13-21)24(31)27-22-10-4-1-5-11-22/h1,4-5,10-11,21H,2-3,6-9,12-20H2,(H,26,30)(H,27,31)/p+1