3-bromanyl-4-(3-nitrophenyl)-4-oxidanylidene-butanoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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