3-nitro-4-(1-oxidanyl-3-oxidanylidene-prop-1-en-2-yl)benzoic acid

Systemtic Name: 3-nitro-4-(1-oxidanyl-3-oxidanylidene-prop-1-en-2-yl)benzoic acid Openeye Name: 4-(1-formyl-2-hydroxy-vinyl)-3-nitro-benzoic acid CAS Name: 4-(1-hydroxy-3-oxoprop-1-en-2-yl)-3-nitrobenzoic acid IUPAC Name: 4-(1-hydroxy-3-oxoprop-1-en-2-yl)-3-nitrobenzoic acid Traditional Name: 4-(1-formyl-2-hydroxy-vinyl)-3-nitro-benzoic acid Formula: C10H7NO6 MolecularWeight: 237.16568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H7NO6/c12-4-7(5-13)8-2-1-6(10(14)15)3-9(8)11(16)17/h1-5,12H,(H,14,15)