1-[(2,3-dimethoxyphenyl)methyl]-4-(pyridin-2-ylmethyl)piperazine; ethanedioic acid

Systemtic Name: 1-[(2,3-dimethoxyphenyl)methyl]-4-(pyridin-2-ylmethyl)piperazine; ethanedioic acid Openeye Name: 1-[(2,3-dimethoxyphenyl)methyl]-4-(2-pyridylmethyl)piperazine; oxalic acid CAS Name: 1-[(2,3-dimethoxyphenyl)methyl]-4-(2-pyridinylmethyl)piperazine; oxalic acid IUPAC Name: 1-[(2,3-dimethoxyphenyl)methyl]-4-(pyridin-2-ylmethyl)piperazine; oxalic acid Traditional Name: 1-o-veratryl-4-(2-pyridylmethyl)piperazine; oxalic acid Formula: C21H27N3O6 MolecularWeight: 417.45558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CN2CCN(CC2)CC3=CC=CC=N3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC(=C1OC)CN2CCN(CC2)CC3=CC=CC=N3.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H25N3O2.C2H2O4/c1-23-18-8-5-6-16(19(18)24-2)14-21-10-12-22(13-11-21)15-17-7-3-4-9-20-17;3-1(4)2(5)6/h3-9H,10-15H2,1-2H3;(H,3,4)(H,5,6)