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

Systemtic Name: ethanedioic acid; 1-(2-fluorophenyl)-4-[1-(pyridin-4-ylmethyl)piperidin-4-yl]piperazine Openeye Name: 1-(2-fluorophenyl)-4-[1-(4-pyridylmethyl)-4-piperidyl]piperazine; oxalic acid CAS Name: 1-(2-fluorophenyl)-4-[1-(pyridin-4-ylmethyl)-4-piperidinyl]piperazine; oxalic acid IUPAC Name: 1-(2-fluorophenyl)-4-[1-(pyridin-4-ylmethyl)piperidin-4-yl]piperazine; oxalic acid Traditional Name: 1-(2-fluorophenyl)-4-[1-(4-pyridylmethyl)-4-piperidyl]piperazine; oxalic acid Formula: C23H29FN4O4 MolecularWeight: 444.499163

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CCN(CC2)C3=CC=CC=C3F)CC4=CC=NC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCC1N2CCN(CC2)C3=CC=CC=C3F)CC4=CC=NC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H27FN4.C2H2O4/c22-20-3-1-2-4-21(20)26-15-13-25(14-16-26)19-7-11-24(12-8-19)17-18-5-9-23-10-6-18;3-1(4)2(5)6/h1-6,9-10,19H,7-8,11-17H2;(H,3,4)(H,5,6)