1-cyclohexyloxy-3-piperidin-1-ium-1-yl-propan-2-ol; ethanedioic acid

Systemtic Name: 1-cyclohexyloxy-3-piperidin-1-ium-1-yl-propan-2-ol; ethanedioic acid Openeye Name: 1-(cyclohexoxy)-3-piperidin-1-ium-1-yl-propan-2-ol; oxalic acid CAS Name: 1-cyclohexyloxy-3-(1-piperidin-1-iumyl)-2-propanol; oxalic acid IUPAC Name: 1-cyclohexyloxy-3-piperidin-1-ium-1-ylpropan-2-ol; oxalic acid Traditional Name: 1-(cyclohexoxy)-3-piperidin-1-ium-1-yl-propan-2-ol; oxalic acid Formula: C16H30NO6+ MolecularWeight: 332.4125

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OCC(C[NH+]2CCCCC2)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCC(CC1)OCC(C[NH+]2CCCCC2)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H27NO2.C2H2O4/c16-13(11-15-9-5-2-6-10-15)12-17-14-7-3-1-4-8-14;3-1(4)2(5)6/h13-14,16H,1-12H2;(H,3,4)(H,5,6)/p+1