1-[1-[(2-hydroxyphenyl)methyl]piperidin-1-ium-4-yl]-N-phenethyl-piperidine-4-carboxamide

Systemtic Name: 1-[1-[(2-hydroxyphenyl)methyl]piperidin-1-ium-4-yl]-N-phenethyl-piperidine-4-carboxamide Openeye Name: 1-[1-[(2-hydroxyphenyl)methyl]piperidin-1-ium-4-yl]-N-phenethyl-piperidine-4-carboxamide CAS Name: 1-[1-[(2-hydroxyphenyl)methyl]-4-piperidin-1-iumyl]-N-phenethyl-4-piperidinecarboxamide IUPAC Name: 1-[1-[(2-hydroxyphenyl)methyl]piperidin-1-ium-4-yl]-N-phenethylpiperidine-4-carboxamide Traditional Name: N-phenethyl-1-(1-salicylpiperidin-1-ium-4-yl)isonipecotamide Formula: C26H36N3O2+ MolecularWeight: 422.58294

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2CCC(CC2)C(=O)NCCC3=CC=CC=C3)CC4=CC=CC=C4O

Isomeric SMILES

C1C[NH+](CCC1N2CCC(CC2)C(=O)NCCC3=CC=CC=C3)CC4=CC=CC=C4O

InChI

InChI=1S/C26H35N3O2/c30-25-9-5-4-8-23(25)20-28-16-13-24(14-17-28)29-18-11-22(12-19-29)26(31)27-15-10-21-6-2-1-3-7-21/h1-9,22,24,30H,10-20H2,(H,27,31)/p+1