3-methyl-6-nitro-2H-1,4-benzodioxine-3-carboxylic acid

Systemtic Name: 3-methyl-6-nitro-2H-1,4-benzodioxine-3-carboxylic acid Openeye Name: 3-methyl-6-nitro-2H-1,4-benzodioxine-3-carboxylic acid CAS Name: 3-methyl-6-nitro-2H-1,4-benzodioxin-3-carboxylic acid IUPAC Name: 3-methyl-6-nitro-2H-1,4-benzodioxine-3-carboxylic acid Traditional Name: 3-methyl-6-nitro-2H-1,4-benzodioxin-3-carboxylic acid Formula: C10H9NO6 MolecularWeight: 239.18156

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(O1)C=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1(COC2=C(O1)C=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C10H9NO6/c1-10(9(12)13)5-16-7-3-2-6(11(14)15)4-8(7)17-10/h2-4H,5H2,1H3,(H,12,13)