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

Systemtic Name: ethanedioic acid; 1-(2-methoxyphenyl)-4-[1-[(3-methylphenyl)methyl]piperidin-4-yl]piperazine Openeye Name: 1-(2-methoxyphenyl)-4-[1-(m-tolylmethyl)-4-piperidyl]piperazine; oxalic acid CAS Name: 1-(2-methoxyphenyl)-4-[1-[(3-methylphenyl)methyl]-4-piperidinyl]piperazine; oxalic acid IUPAC Name: 1-(2-methoxyphenyl)-4-[1-[(3-methylphenyl)methyl]piperidin-4-yl]piperazine; oxalic acid Traditional Name: 1-(2-methoxyphenyl)-4-[1-(3-methylbenzyl)-4-piperidyl]piperazine; oxalic acid Formula: C26H35N3O5 MolecularWeight: 469.5732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCC(CC2)N3CCN(CC3)C4=CC=CC=C4OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCC(CC2)N3CCN(CC3)C4=CC=CC=C4OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H33N3O.C2H2O4/c1-20-6-5-7-21(18-20)19-25-12-10-22(11-13-25)26-14-16-27(17-15-26)23-8-3-4-9-24(23)28-2;3-1(4)2(5)6/h3-9,18,22H,10-17,19H2,1-2H3;(H,3,4)(H,5,6)