1-[4,6-bis(chloranyl)-1-benzofuran-7-yl]piperazine; ethanedioic acid

Systemtic Name: 1-[4,6-bis(chloranyl)-1-benzofuran-7-yl]piperazine; ethanedioic acid Openeye Name: 1-(4,6-dichlorobenzofuran-7-yl)piperazine; oxalic acid CAS Name: 1-(4,6-dichloro-7-benzofuranyl)piperazine; oxalic acid IUPAC Name: 1-(4,6-dichloro-1-benzofuran-7-yl)piperazine; oxalic acid Traditional Name: 1-(4,6-dichlorobenzofuran-7-yl)piperazine; oxalic acid Formula: C14H14Cl2N2O5 MolecularWeight: 361.17736

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C(C3=C2OC=C3)Cl)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1)C2=C(C=C(C3=C2OC=C3)Cl)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H12Cl2N2O.C2H2O4/c13-9-7-10(14)11(12-8(9)1-6-17-12)16-4-2-15-3-5-16;3-1(4)2(5)6/h1,6-7,15H,2-5H2;(H,3,4)(H,5,6)