3,6-bis(chloranyl)-4-methylperoxycarbonyl-2-nitro-benzoic acid

Systemtic Name: 3,6-bis(chloranyl)-4-methylperoxycarbonyl-2-nitro-benzoic acid Openeye Name: 3,6-dichloro-4-methylperoxycarbonyl-2-nitro-benzoic acid CAS Name: 3,6-dichloro-4-[methyldioxy(oxo)methyl]-2-nitrobenzoic acid IUPAC Name: 3,6-dichloro-4-methylperoxycarbonyl-2-nitrobenzoic acid Traditional Name: 3,6-dichloro-4-methylperoxycarbonyl-2-nitro-benzoic acid Formula: C9H5Cl2NO7 MolecularWeight: 310.0445

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Descriptors Computed from Structure

Canonical SMILES:

COOC(=O)C1=CC(=C(C(=C1Cl)[N+](=O)[O-])C(=O)O)Cl

Isomeric SMILES

COOC(=O)C1=CC(=C(C(=C1Cl)[N+](=O)[O-])C(=O)O)Cl

InChI

InChI=1S/C9H5Cl2NO7/c1-18-19-9(15)3-2-4(10)5(8(13)14)7(6(3)11)12(16)17/h2H,1H3,(H,13,14)