4-(5-nitro-2-oxidanyl-phenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(5-nitro-2-oxidanyl-phenyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-hydroxy-5-nitro-phenyl)-4-oxo-butanoic acid CAS Name: 4-(2-hydroxy-5-nitrophenyl)-4-oxobutanoic acid IUPAC Name: 4-(2-hydroxy-5-nitrophenyl)-4-oxobutanoic acid Traditional Name: 4-(2-hydroxy-5-nitro-phenyl)-4-keto-butyric acid Formula: C10H9NO6 MolecularWeight: 239.18156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9NO6/c12-8-2-1-6(11(16)17)5-7(8)9(13)3-4-10(14)15/h1-2,5,12H,3-4H2,(H,14,15)