N-[2-(1H-imidazol-3-ium-5-yl)ethyl]-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]piperidine-4-carboxamide

Systemtic Name: N-[2-(1H-imidazol-3-ium-5-yl)ethyl]-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]piperidine-4-carboxamide Openeye Name: N-[2-(1H-imidazol-3-ium-5-yl)ethyl]-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]piperidine-4-carboxamide CAS Name: N-[2-(1H-imidazol-3-ium-5-yl)ethyl]-1-[1-(3-phenylpropyl)-4-piperidin-1-iumyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(1H-imidazol-3-ium-5-yl)ethyl]-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]piperidine-4-carboxamide Traditional Name: N-[2-(1H-imidazol-3-ium-5-yl)ethyl]-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]isonipecotamide Formula: C25H39N5O+2 MolecularWeight: 425.61006

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2CCC(CC2)C(=O)NCCC3=C[NH+]=CN3)CCCC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1N2CCC(CC2)C(=O)NCCC3=C[NH+]=CN3)CCCC4=CC=CC=C4

InChI

InChI=1S/C25H37N5O/c31-25(27-13-8-23-19-26-20-28-23)22-9-17-30(18-10-22)24-11-15-29(16-12-24)14-4-7-21-5-2-1-3-6-21/h1-3,5-6,19-20,22,24H,4,7-18H2,(H,26,28)(H,27,31)/p+2