1-[(2,4-dimethoxy-3-methyl-phenyl)methyl]-4-pyridin-2-yl-piperazine; ethanedioic acid

Systemtic Name: 1-[(2,4-dimethoxy-3-methyl-phenyl)methyl]-4-pyridin-2-yl-piperazine; ethanedioic acid Openeye Name: 1-[(2,4-dimethoxy-3-methyl-phenyl)methyl]-4-(2-pyridyl)piperazine; oxalic acid CAS Name: 1-[(2,4-dimethoxy-3-methylphenyl)methyl]-4-(2-pyridinyl)piperazine; oxalic acid IUPAC Name: 1-[(2,4-dimethoxy-3-methylphenyl)methyl]-4-pyridin-2-ylpiperazine; oxalic acid Traditional Name: 1-(2,4-dimethoxy-3-methyl-benzyl)-4-(2-pyridyl)piperazine; oxalic acid Formula: C21H27N3O6 MolecularWeight: 417.45558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1OC)CN2CCN(CC2)C3=CC=CC=N3)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C=CC(=C1OC)CN2CCN(CC2)C3=CC=CC=N3)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H25N3O2.C2H2O4/c1-15-17(23-2)8-7-16(19(15)24-3)14-21-10-12-22(13-11-21)18-6-4-5-9-20-18;3-1(4)2(5)6/h4-9H,10-14H2,1-3H3;(H,3,4)(H,5,6)