N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N,6-dimethyl-pyridine-3-carboxamide

Systemtic Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N,6-dimethyl-pyridine-3-carboxamide Openeye Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N,6-dimethyl-pyridine-3-carboxamide CAS Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]-3-piperidin-1-iumyl]methyl]-N,6-dimethyl-3-pyridinecarboxamide IUPAC Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N,6-dimethylpyridine-3-carboxamide Traditional Name: N-[[(3R)-1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-3-yl]methyl]-N,6-dimethyl-nicotinamide Formula: C23H32N3O2+ MolecularWeight: 382.51908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C(=O)N(C)CC2CCC[NH+](C2)CCC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=NC=C(C=C1)C(=O)N(C)C[C@H]2CCC[NH+](C2)CCC3=CC=C(C=C3)OC

InChI

InChI=1S/C23H31N3O2/c1-18-6-9-21(15-24-18)23(27)25(2)16-20-5-4-13-26(17-20)14-12-19-7-10-22(28-3)11-8-19/h6-11,15,20H,4-5,12-14,16-17H2,1-3H3/p+1/t20-/m1/s1