(3-ethoxycarbonylfuran-2-yl)methyl 6-nitro-1,3-benzodioxole-5-carboxylate

Systemtic Name: (3-ethoxycarbonylfuran-2-yl)methyl 6-nitro-1,3-benzodioxole-5-carboxylate Openeye Name: (3-ethoxycarbonyl-2-furyl)methyl 6-nitro-1,3-benzodioxole-5-carboxylate CAS Name: 6-nitro-1,3-benzodioxole-5-carboxylic acid (3-ethoxycarbonyl-2-furanyl)methyl ester IUPAC Name: (3-ethoxycarbonylfuran-2-yl)methyl 6-nitro-1,3-benzodioxole-5-carboxylate Traditional Name: 6-nitro-piperonylic acid (3-carbethoxy-2-furyl)methyl ester Formula: C16H13NO9 MolecularWeight: 363.27572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC=C1)COC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

CCOC(=O)C1=C(OC=C1)COC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C16H13NO9/c1-2-22-15(18)9-3-4-23-14(9)7-24-16(19)10-5-12-13(26-8-25-12)6-11(10)17(20)21/h3-6H,2,7-8H2,1H3