4-(nitromethyl)-2-oxidanyl-benzoate

Systemtic Name: 4-(nitromethyl)-2-oxidanyl-benzoate Openeye Name: 2-hydroxy-4-(nitromethyl)benzoate CAS Name: 2-hydroxy-4-(nitromethyl)benzoate IUPAC Name: 2-hydroxy-4-(nitromethyl)benzoate Traditional Name: 2-hydroxy-4-(nitromethyl)benzoate Formula: C8H6NO5- MolecularWeight: 196.13694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H7NO5/c10-7-3-5(4-9(13)14)1-2-6(7)8(11)12/h1-3,10H,4H2,(H,11,12)/p-1