[(3S)-3-(phenylmethyl)-1-(quinolin-2-ylmethyl)piperidin-1-ium-3-yl]methanol

Systemtic Name: [(3S)-3-(phenylmethyl)-1-(quinolin-2-ylmethyl)piperidin-1-ium-3-yl]methanol Openeye Name: [(3S)-3-benzyl-1-(2-quinolylmethyl)piperidin-1-ium-3-yl]methanol CAS Name: [(3S)-3-(phenylmethyl)-1-(2-quinolinylmethyl)-3-piperidin-1-iumyl]methanol IUPAC Name: [(3S)-3-benzyl-1-(quinolin-2-ylmethyl)piperidin-1-ium-3-yl]methanol Traditional Name: [(3S)-3-benzyl-1-(2-quinolylmethyl)piperidin-1-ium-3-yl]methanol Formula: C23H27N2O+ MolecularWeight: 347.47328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=NC3=CC=CC=C3C=C2)(CC4=CC=CC=C4)CO

Isomeric SMILES

C1C[C@@](C[NH+](C1)CC2=NC3=CC=CC=C3C=C2)(CC4=CC=CC=C4)CO

InChI

InChI=1S/C23H26N2O/c26-18-23(15-19-7-2-1-3-8-19)13-6-14-25(17-23)16-21-12-11-20-9-4-5-10-22(20)24-21/h1-5,7-12,26H,6,13-18H2/p+1/t23-/m0/s1