(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl 6-nitro-1,3-benzodioxole-5-carboxylate

Systemtic Name: (6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl 6-nitro-1,3-benzodioxole-5-carboxylate Openeye Name: (6-fluoro-4H-1,3-benzodioxin-8-yl)methyl 6-nitro-1,3-benzodioxole-5-carboxylate CAS Name: 6-nitro-1,3-benzodioxole-5-carboxylic acid (6-fluoro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-fluoro-4H-1,3-benzodioxin-8-yl)methyl 6-nitro-1,3-benzodioxole-5-carboxylate Traditional Name: 6-nitro-piperonylic acid (6-fluoro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C17H12FNO8 MolecularWeight: 377.277483

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=CC4=C(C=C3[N+](=O)[O-])OCO4)F

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC(=O)C3=CC4=C(C=C3[N+](=O)[O-])OCO4)F

InChI

InChI=1S/C17H12FNO8/c18-11-1-9-5-23-7-27-16(9)10(2-11)6-24-17(20)12-3-14-15(26-8-25-14)4-13(12)19(21)22/h1-4H,5-8H2