5-bromanyl-4-nitro-1-benzofuran-3-carboxylic acid

Systemtic Name: 5-bromanyl-4-nitro-1-benzofuran-3-carboxylic acid Openeye Name: 5-bromo-4-nitro-benzofuran-3-carboxylic acid CAS Name: 5-bromo-4-nitro-3-benzofurancarboxylic acid IUPAC Name: 5-bromo-4-nitro-1-benzofuran-3-carboxylic acid Traditional Name: 5-bromo-4-nitro-benzofuran-3-carboxylic acid Formula: C9H4BrNO5 MolecularWeight: 286.03576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C2=C1OC=C2C(=O)O)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=C(C2=C1OC=C2C(=O)O)[N+](=O)[O-])Br

InChI

InChI=1S/C9H4BrNO5/c10-5-1-2-6-7(8(5)11(14)15)4(3-16-6)9(12)13/h1-3H,(H,12,13)