6-nitro-1,3-benzodioxole-5-carbonyl chloride

Systemtic Name: 6-nitro-1,3-benzodioxole-5-carbonyl chloride Openeye Name: 6-nitro-1,3-benzodioxole-5-carbonyl chloride CAS Name: 6-nitro-1,3-benzodioxole-5-carbonyl chloride IUPAC Name: 6-nitro-1,3-benzodioxole-5-carbonyl chloride Traditional Name: 6-nitro-1,3-benzodioxole-5-carbonyl chloride Formula: C8H4ClNO5 MolecularWeight: 229.57406

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C(=O)Cl)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C(=O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C8H4ClNO5/c9-8(11)4-1-6-7(15-3-14-6)2-5(4)10(12)13/h1-2H,3H2