(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2,3-dihydro-1,4-dioxine-5-carboxylate

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2,3-dihydro-1,4-dioxine-5-carboxylate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2,3-dihydro-1,4-dioxine-5-carboxylate CAS Name: 2,3-dihydro-1,4-dioxin-5-carboxylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2,3-dihydro-1,4-dioxine-5-carboxylate Traditional Name: 2,3-dihydro-p-dioxin-5-carboxylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C14H13NO8 MolecularWeight: 323.25492

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=CO1)C(=O)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

Isomeric SMILES

C1COC(=CO1)C(=O)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

InChI

InChI=1S/C14H13NO8/c16-14(12-7-19-1-2-21-12)22-6-10-4-11(15(17)18)3-9-5-20-8-23-13(9)10/h3-4,7H,1-2,5-6,8H2