(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-methylfuran-3-carboxylate

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-methylfuran-3-carboxylate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-methylfuran-3-carboxylate CAS Name: 2-methyl-3-furancarboxylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-methylfuran-3-carboxylate Traditional Name: 2-methylfuran-3-carboxylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C15H13NO7 MolecularWeight: 319.26622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

Isomeric SMILES

CC1=C(C=CO1)C(=O)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

InChI

InChI=1S/C15H13NO7/c1-9-13(2-3-21-9)15(17)22-7-11-5-12(16(18)19)4-10-6-20-8-23-14(10)11/h2-5H,6-8H2,1H3