3-[[(3S)-3-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-1-yl]methyl]pyridine

Systemtic Name: 3-[[(3S)-3-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-1-yl]methyl]pyridine Openeye Name: 3-[[(3S)-3-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-1-yl]methyl]pyridine CAS Name: 3-[[(3S)-3-[2-(4-methoxyphenyl)ethyl]-1-piperidin-1-iumyl]methyl]pyridine IUPAC Name: 3-[[(3S)-3-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-1-yl]methyl]pyridine Traditional Name: 3-[[(3S)-3-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-1-yl]methyl]pyridine Formula: C20H27N2O+ MolecularWeight: 311.44118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC2CCC[NH+](C2)CC3=CN=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)CC[C@H]2CCC[NH+](C2)CC3=CN=CC=C3

InChI

InChI=1S/C20H26N2O/c1-23-20-10-8-17(9-11-20)6-7-18-5-3-13-22(15-18)16-19-4-2-12-21-14-19/h2,4,8-12,14,18H,3,5-7,13,15-16H2,1H3/p+1/t18-/m1/s1