ethanedioic acid; 1-(2-methoxyphenyl)-4-[1-(pyridin-3-ylmethyl)piperidin-4-yl]piperazine

Systemtic Name: ethanedioic acid; 1-(2-methoxyphenyl)-4-[1-(pyridin-3-ylmethyl)piperidin-4-yl]piperazine Openeye Name: 1-(2-methoxyphenyl)-4-[1-(3-pyridylmethyl)-4-piperidyl]piperazine; oxalic acid CAS Name: 1-(2-methoxyphenyl)-4-[1-(3-pyridinylmethyl)-4-piperidinyl]piperazine; oxalic acid IUPAC Name: 1-(2-methoxyphenyl)-4-[1-(pyridin-3-ylmethyl)piperidin-4-yl]piperazine; oxalic acid Traditional Name: 1-(2-methoxyphenyl)-4-[1-(3-pyridylmethyl)-4-piperidyl]piperazine; oxalic acid Formula: C24H32N4O5 MolecularWeight: 456.53468

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3CCN(CC3)CC4=CN=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3CCN(CC3)CC4=CN=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H30N4O.C2H2O4/c1-27-22-7-3-2-6-21(22)26-15-13-25(14-16-26)20-8-11-24(12-9-20)18-19-5-4-10-23-17-19;3-1(4)2(5)6/h2-7,10,17,20H,8-9,11-16,18H2,1H3;(H,3,4)(H,5,6)