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

Systemtic Name: ethanedioic acid; 1-[(4-methoxy-3-phenylmethoxy-phenyl)methyl]-4-pyridin-2-yl-piperazine Openeye Name: 1-[(3-benzyloxy-4-methoxy-phenyl)methyl]-4-(2-pyridyl)piperazine; oxalic acid CAS Name: 1-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-4-(2-pyridinyl)piperazine; oxalic acid IUPAC Name: 1-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-4-pyridin-2-ylpiperazine; oxalic acid Traditional Name: 1-(3-benzoxy-4-methoxy-benzyl)-4-(2-pyridyl)piperazine; oxalic acid Formula: C26H29N3O6 MolecularWeight: 479.52496

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C3=CC=CC=N3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C3=CC=CC=N3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H27N3O2.C2H2O4/c1-28-22-11-10-21(17-23(22)29-19-20-7-3-2-4-8-20)18-26-13-15-27(16-14-26)24-9-5-6-12-25-24;3-1(4)2(5)6/h2-12,17H,13-16,18-19H2,1H3;(H,3,4)(H,5,6)