(3-fluoranyl-4-methoxy-phenyl)methyl 6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxylate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxylate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxylate CAS Name: 6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxylate Traditional Name: 6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C17H14FNO7 MolecularWeight: 363.293963

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3)F

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3)F

InChI

InChI=1S/C17H14FNO7/c1-23-14-3-2-10(6-12(14)18)9-26-17(20)11-7-15-16(25-5-4-24-15)8-13(11)19(21)22/h2-3,6-8H,4-5,9H2,1H3