[2-[3,4-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 6-nitro-1,3-benzodioxole-5-carboxylate

Systemtic Name: [2-[3,4-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 6-nitro-1,3-benzodioxole-5-carboxylate Openeye Name: [2-(3,4-difluorophenyl)-2-oxo-ethyl] 6-nitro-1,3-benzodioxole-5-carboxylate CAS Name: 6-nitro-1,3-benzodioxole-5-carboxylic acid [2-(3,4-difluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-difluorophenyl)-2-oxoethyl] 6-nitro-1,3-benzodioxole-5-carboxylate Traditional Name: 6-nitro-piperonylic acid [2-(3,4-difluorophenyl)-2-keto-ethyl] ester Formula: C16H9F2NO7 MolecularWeight: 365.241966

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C(=O)OCC(=O)C3=CC(=C(C=C3)F)F)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C(=O)OCC(=O)C3=CC(=C(C=C3)F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H9F2NO7/c17-10-2-1-8(3-11(10)18)13(20)6-24-16(21)9-4-14-15(26-7-25-14)5-12(9)19(22)23/h1-5H,6-7H2