ethanedioic acid; 1-(5-fluoranyl-4-methyl-1-benzofuran-7-yl)piperazine

Systemtic Name: ethanedioic acid; 1-(5-fluoranyl-4-methyl-1-benzofuran-7-yl)piperazine Openeye Name: 1-(5-fluoro-4-methyl-benzofuran-7-yl)piperazine; oxalic acid CAS Name: 1-(5-fluoro-4-methyl-7-benzofuranyl)piperazine; oxalic acid IUPAC Name: 1-(5-fluoro-4-methyl-1-benzofuran-7-yl)piperazine; oxalic acid Traditional Name: 1-(5-fluoro-4-methyl-benzofuran-7-yl)piperazine; oxalic acid Formula: C15H17FN2O5 MolecularWeight: 324.304283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C2=C1C=CO2)N3CCNCC3)F.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C=C(C2=C1C=CO2)N3CCNCC3)F.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H15FN2O.C2H2O4/c1-9-10-2-7-17-13(10)12(8-11(9)14)16-5-3-15-4-6-16;3-1(4)2(5)6/h2,7-8,15H,3-6H2,1H3;(H,3,4)(H,5,6)