3-[[(3S)-3-phenethylpiperidin-1-ium-1-yl]methyl]pyridine

Systemtic Name: 3-[[(3S)-3-phenethylpiperidin-1-ium-1-yl]methyl]pyridine Openeye Name: 3-[[(3S)-3-phenethylpiperidin-1-ium-1-yl]methyl]pyridine CAS Name: 3-[[(3S)-3-phenethyl-1-piperidin-1-iumyl]methyl]pyridine IUPAC Name: 3-[[(3S)-3-phenethylpiperidin-1-ium-1-yl]methyl]pyridine Traditional Name: 3-[[(3S)-3-phenethylpiperidin-1-ium-1-yl]methyl]pyridine Formula: C19H25N2+ MolecularWeight: 281.4152

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CN=CC=C2)CCC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CN=CC=C2)CCC3=CC=CC=C3

InChI

InChI=1S/C19H24N2/c1-2-6-17(7-3-1)10-11-18-9-5-13-21(15-18)16-19-8-4-12-20-14-19/h1-4,6-8,12,14,18H,5,9-11,13,15-16H2/p+1/t18-/m1/s1