ethanedioic acid; 3-[4-(2-methoxyphenyl)piperazin-1-yl]propane-1,2-diol

Systemtic Name: ethanedioic acid; 3-[4-(2-methoxyphenyl)piperazin-1-yl]propane-1,2-diol Openeye Name: 3-[4-(2-methoxyphenyl)piperazin-1-yl]propane-1,2-diol; oxalic acid CAS Name: 3-[4-(2-methoxyphenyl)-1-piperazinyl]propane-1,2-diol; oxalic acid IUPAC Name: 3-[4-(2-methoxyphenyl)piperazin-1-yl]propane-1,2-diol; oxalic acid Traditional Name: 3-[4-(2-methoxyphenyl)piperazino]propane-1,2-diol; oxalic acid Formula: C16H24N2O7 MolecularWeight: 356.37096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CC(CO)O.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CC(CO)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H22N2O3.C2H2O4/c1-19-14-5-3-2-4-13(14)16-8-6-15(7-9-16)10-12(18)11-17;3-1(4)2(5)6/h2-5,12,17-18H,6-11H2,1H3;(H,3,4)(H,5,6)