[(3S)-1,3-bis[(2-methylphenyl)methyl]piperidin-1-ium-3-yl]methanol

Systemtic Name: [(3S)-1,3-bis[(2-methylphenyl)methyl]piperidin-1-ium-3-yl]methanol Openeye Name: [(3S)-1,3-bis(o-tolylmethyl)piperidin-1-ium-3-yl]methanol CAS Name: [(3S)-1,3-bis[(2-methylphenyl)methyl]-3-piperidin-1-iumyl]methanol IUPAC Name: [(3S)-1,3-bis[(2-methylphenyl)methyl]piperidin-1-ium-3-yl]methanol Traditional Name: [(3S)-1,3-bis(2-methylbenzyl)piperidin-1-ium-3-yl]methanol Formula: C22H30NO+ MolecularWeight: 324.4797

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC2(CCC[NH+](C2)CC3=CC=CC=C3C)CO

Isomeric SMILES

CC1=CC=CC=C1C[C@]2(CCC[NH+](C2)CC3=CC=CC=C3C)CO

InChI

InChI=1S/C22H29NO/c1-18-8-3-5-10-20(18)14-22(17-24)12-7-13-23(16-22)15-21-11-6-4-9-19(21)2/h3-6,8-11,24H,7,12-17H2,1-2H3/p+1/t22-/m0/s1