1-(5-nitro-2-oxidanyl-phenyl)propan-1-one

Systemtic Name: 1-(5-nitro-2-oxidanyl-phenyl)propan-1-one Openeye Name: 1-(2-hydroxy-5-nitro-phenyl)propan-1-one CAS Name: 1-(2-hydroxy-5-nitrophenyl)-1-propanone IUPAC Name: 1-(2-hydroxy-5-nitrophenyl)propan-1-one Traditional Name: 1-(2-hydroxy-5-nitro-phenyl)propan-1-one Formula: C9H9NO4 MolecularWeight: 195.17206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9NO4/c1-2-8(11)7-5-6(10(13)14)3-4-9(7)12/h3-5,12H,2H2,1H3