2-[4-(4-fluoranyl-2-nitro-phenyl)piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-(4-fluoranyl-2-nitro-phenyl)piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(4-fluoro-2-nitro-phenyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-(4-fluoro-2-nitrophenyl)-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(4-fluoro-2-nitrophenyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(4-fluoro-2-nitro-phenyl)piperazino]acetic acid Formula: C12H14FN3O4 MolecularWeight: 283.255663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)C2=C(C=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC(=O)O)C2=C(C=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C12H14FN3O4/c13-9-1-2-10(11(7-9)16(19)20)15-5-3-14(4-6-15)8-12(17)18/h1-2,7H,3-6,8H2,(H,17,18)