ethanedioic acid; 1-(2-fluorophenyl)-2-(4-methylpiperazin-1-yl)ethanone

Systemtic Name: ethanedioic acid; 1-(2-fluorophenyl)-2-(4-methylpiperazin-1-yl)ethanone Openeye Name: 1-(2-fluorophenyl)-2-(4-methylpiperazin-1-yl)ethanone; oxalic acid CAS Name: 1-(2-fluorophenyl)-2-(4-methyl-1-piperazinyl)ethanone; oxalic acid IUPAC Name: 1-(2-fluorophenyl)-2-(4-methylpiperazin-1-yl)ethanone; oxalic acid Traditional Name: 1-(2-fluorophenyl)-2-(4-methylpiperazino)ethanone; oxalic acid Formula: C15H19FN2O5 MolecularWeight: 326.320163

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC(=O)C2=CC=CC=C2F.C(=O)(C(=O)O)O

Isomeric SMILES

CN1CCN(CC1)CC(=O)C2=CC=CC=C2F.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H17FN2O.C2H2O4/c1-15-6-8-16(9-7-15)10-13(17)11-4-2-3-5-12(11)14;3-1(4)2(5)6/h2-5H,6-10H2,1H3;(H,3,4)(H,5,6)