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

Systemtic Name: ethanedioic acid; 1-(2-fluorophenyl)-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine Openeye Name: 1-(2-fluorophenyl)-4-[1-(4-phenylcyclohexyl)-4-piperidyl]piperazine; oxalic acid CAS Name: 1-(2-fluorophenyl)-4-[1-(4-phenylcyclohexyl)-4-piperidinyl]piperazine; oxalic acid IUPAC Name: 1-(2-fluorophenyl)-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine; oxalic acid Traditional Name: 1-(2-fluorophenyl)-4-[1-(4-phenylcyclohexyl)-4-piperidyl]piperazine; oxalic acid Formula: C29H38FN3O4 MolecularWeight: 511.628123

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=CC=CC=C2)N3CCC(CC3)N4CCN(CC4)C5=CC=CC=C5F.C(=O)(C(=O)O)O

Isomeric SMILES

C1CC(CCC1C2=CC=CC=C2)N3CCC(CC3)N4CCN(CC4)C5=CC=CC=C5F.C(=O)(C(=O)O)O

InChI

InChI=1S/C27H36FN3.C2H2O4/c28-26-8-4-5-9-27(26)31-20-18-30(19-21-31)25-14-16-29(17-15-25)24-12-10-23(11-13-24)22-6-2-1-3-7-22;3-1(4)2(5)6/h1-9,23-25H,10-21H2;(H,3,4)(H,5,6)