6-chloranyl-5-nitro-3-oxidanyl-3H-2-benzofuran-1-one

Systemtic Name: 6-chloranyl-5-nitro-3-oxidanyl-3H-2-benzofuran-1-one Openeye Name: 6-chloro-3-hydroxy-5-nitro-3H-isobenzofuran-1-one CAS Name: 6-chloro-3-hydroxy-5-nitro-3H-isobenzofuran-1-one IUPAC Name: 6-chloro-3-hydroxy-5-nitro-3H-2-benzofuran-1-one Traditional Name: 6-chloro-3-hydroxy-5-nitro-phthalide Formula: C8H4ClNO5 MolecularWeight: 229.57406

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(OC(=O)C2=CC(=C1[N+](=O)[O-])Cl)O

Isomeric SMILES

C1=C2C(OC(=O)C2=CC(=C1[N+](=O)[O-])Cl)O

InChI

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