2-[3-ethyl-2,5-bis(fluoranyl)-4-nitro-phenyl]ethanoic acid

Systemtic Name: 2-[3-ethyl-2,5-bis(fluoranyl)-4-nitro-phenyl]ethanoic acid Openeye Name: 2-(3-ethyl-2,5-difluoro-4-nitro-phenyl)acetic acid CAS Name: 2-(3-ethyl-2,5-difluoro-4-nitrophenyl)acetic acid IUPAC Name: 2-(3-ethyl-2,5-difluoro-4-nitrophenyl)acetic acid Traditional Name: 2-(3-ethyl-2,5-difluoro-4-nitro-phenyl)acetic acid Formula: C10H9F2NO4 MolecularWeight: 245.179566

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1[N+](=O)[O-])F)CC(=O)O)F

Isomeric SMILES

CCC1=C(C(=CC(=C1[N+](=O)[O-])F)CC(=O)O)F

InChI

InChI=1S/C10H9F2NO4/c1-2-6-9(12)5(4-8(14)15)3-7(11)10(6)13(16)17/h3H,2,4H2,1H3,(H,14,15)