4-(4-bromanyl-3-nitro-phenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(4-bromanyl-3-nitro-phenyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-bromo-3-nitro-phenyl)-4-oxo-butanoic acid CAS Name: 4-(4-bromo-3-nitrophenyl)-4-oxobutanoic acid IUPAC Name: 4-(4-bromo-3-nitrophenyl)-4-oxobutanoic acid Traditional Name: 4-(4-bromo-3-nitro-phenyl)-4-keto-butyric acid Formula: C10H8BrNO5 MolecularWeight: 302.07822

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)CCC(=O)O)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=C(C=C1C(=O)CCC(=O)O)[N+](=O)[O-])Br

InChI

InChI=1S/C10H8BrNO5/c11-7-2-1-6(5-8(7)12(16)17)9(13)3-4-10(14)15/h1-2,5H,3-4H2,(H,14,15)