2-(3-bromanyl-4-nitro-phenyl)ethanoic acid

Systemtic Name: 2-(3-bromanyl-4-nitro-phenyl)ethanoic acid Openeye Name: 2-(3-bromo-4-nitro-phenyl)acetic acid CAS Name: 2-(3-bromo-4-nitrophenyl)acetic acid IUPAC Name: 2-(3-bromo-4-nitrophenyl)acetic acid Traditional Name: 2-(3-bromo-4-nitro-phenyl)acetic acid Formula: C8H6BrNO4 MolecularWeight: 260.04154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC(=O)O)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1CC(=O)O)Br)[N+](=O)[O-]

InChI

InChI=1S/C8H6BrNO4/c9-6-3-5(4-8(11)12)1-2-7(6)10(13)14/h1-3H,4H2,(H,11,12)