(3R)-1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-1-ium-3-ol

Systemtic Name: (3R)-1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-1-ium-3-ol Openeye Name: (3R)-1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-1-ium-3-ol CAS Name: (3R)-1-[(2,4,5-trimethoxyphenyl)methyl]-3-piperidin-1-iumol IUPAC Name: (3R)-1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-1-ium-3-ol Traditional Name: (3R)-1-(2,4,5-trimethoxybenzyl)piperidin-1-ium-3-ol Formula: C15H24NO4+ MolecularWeight: 282.35536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C[NH+]2CCCC(C2)O)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C[NH+]2CCC[C@H](C2)O)OC)OC

InChI

InChI=1S/C15H23NO4/c1-18-13-8-15(20-3)14(19-2)7-11(13)9-16-6-4-5-12(17)10-16/h7-8,12,17H,4-6,9-10H2,1-3H3/p+1/t12-/m1/s1