2-[4-[3,4-bis(fluoranyl)phenyl]carbonylpiperazin-1-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[4-[3,4-bis(fluoranyl)phenyl]carbonylpiperazin-1-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-(3,4-difluorobenzoyl)piperazin-1-yl]-2-oxo-acetic acid CAS Name: 2-[4-[(3,4-difluorophenyl)-oxomethyl]-1-piperazinyl]-2-oxoacetic acid IUPAC Name: 2-[4-(3,4-difluorobenzoyl)piperazin-1-yl]-2-oxoacetic acid Traditional Name: 2-[4-(3,4-difluorobenzoyl)piperazino]-2-keto-acetic acid Formula: C13H12F2N2O4 MolecularWeight: 298.242186

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=C(C=C2)F)F)C(=O)C(=O)O

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=C(C=C2)F)F)C(=O)C(=O)O

InChI

InChI=1S/C13H12F2N2O4/c14-9-2-1-8(7-10(9)15)11(18)16-3-5-17(6-4-16)12(19)13(20)21/h1-2,7H,3-6H2,(H,20,21)