(2S)-1-[4-(phenylmethyl)piperidin-1-ium-1-yl]-3-propan-2-yloxy-propan-2-ol

Systemtic Name: (2S)-1-[4-(phenylmethyl)piperidin-1-ium-1-yl]-3-propan-2-yloxy-propan-2-ol Openeye Name: (2S)-1-(4-benzylpiperidin-1-ium-1-yl)-3-isopropoxy-propan-2-ol CAS Name: (2S)-1-[4-(phenylmethyl)-1-piperidin-1-iumyl]-3-propan-2-yloxy-2-propanol IUPAC Name: (2S)-1-(4-benzylpiperidin-1-ium-1-yl)-3-propan-2-yloxypropan-2-ol Traditional Name: (2S)-1-(4-benzylpiperidin-1-ium-1-yl)-3-isopropoxy-propan-2-ol Formula: C18H30NO2+ MolecularWeight: 292.4363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC(C[NH+]1CCC(CC1)CC2=CC=CC=C2)O

Isomeric SMILES

CC(C)OC[C@H](C[NH+]1CCC(CC1)CC2=CC=CC=C2)O

InChI

InChI=1S/C18H29NO2/c1-15(2)21-14-18(20)13-19-10-8-17(9-11-19)12-16-6-4-3-5-7-16/h3-7,15,17-18,20H,8-14H2,1-2H3/p+1/t18-/m0/s1