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

Systemtic Name: ethanedioic acid; 1-[1-[(2-methylphenyl)methyl]piperidin-4-yl]-4-phenyl-piperazine Openeye Name: 1-[1-(o-tolylmethyl)-4-piperidyl]-4-phenyl-piperazine; oxalic acid CAS Name: 1-[1-[(2-methylphenyl)methyl]-4-piperidinyl]-4-phenylpiperazine; oxalic acid IUPAC Name: 1-[1-[(2-methylphenyl)methyl]piperidin-4-yl]-4-phenylpiperazine; oxalic acid Traditional Name: 1-[1-(2-methylbenzyl)-4-piperidyl]-4-phenyl-piperazine; oxalic acid Formula: C25H33N3O4 MolecularWeight: 439.54722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCC(CC2)N3CCN(CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=CC=C1CN2CCC(CC2)N3CCN(CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H31N3.C2H2O4/c1-20-7-5-6-8-21(20)19-24-13-11-23(12-14-24)26-17-15-25(16-18-26)22-9-3-2-4-10-22;3-1(4)2(5)6/h2-10,23H,11-19H2,1H3;(H,3,4)(H,5,6)