(2-methoxycarbonylfuran-3-yl)methyl 6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxylate

Systemtic Name: (2-methoxycarbonylfuran-3-yl)methyl 6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxylate Openeye Name: (2-methoxycarbonyl-3-furyl)methyl 6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxylate CAS Name: 6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid (2-methoxycarbonyl-3-furanyl)methyl ester IUPAC Name: (2-methoxycarbonylfuran-3-yl)methyl 6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxylate Traditional Name: 6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid (2-carbomethoxy-3-furyl)methyl ester Formula: C16H13NO9 MolecularWeight: 363.27572

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CO1)COC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3

Isomeric SMILES

COC(=O)C1=C(C=CO1)COC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3

InChI

InChI=1S/C16H13NO9/c1-22-16(19)14-9(2-3-25-14)8-26-15(18)10-6-12-13(24-5-4-23-12)7-11(10)17(20)21/h2-3,6-7H,4-5,8H2,1H3