1-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-N-phenethyl-piperidine-4-carboxamide

Systemtic Name: 1-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-N-phenethyl-piperidine-4-carboxamide Openeye Name: 1-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-N-phenethyl-piperidine-4-carboxamide CAS Name: 1-[1-[[(1S)-1-cyclohex-3-enyl]methyl]-4-piperidin-1-iumyl]-N-phenethyl-4-piperidinecarboxamide IUPAC Name: 1-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-N-phenethylpiperidine-4-carboxamide Traditional Name: 1-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-N-phenethyl-isonipecotamide Formula: C26H40N3O+ MolecularWeight: 410.6153

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C[NH+]2CCC(CC2)N3CCC(CC3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](CC=C1)C[NH+]2CCC(CC2)N3CCC(CC3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C26H39N3O/c30-26(27-16-11-22-7-3-1-4-8-22)24-12-19-29(20-13-24)25-14-17-28(18-15-25)21-23-9-5-2-6-10-23/h1-5,7-8,23-25H,6,9-21H2,(H,27,30)/p+1/t23-/m1/s1