2-(3-nitro-2-oxidanyl-phenyl)propanal

Systemtic Name: 2-(3-nitro-2-oxidanyl-phenyl)propanal Openeye Name: 2-(2-hydroxy-3-nitro-phenyl)propanal CAS Name: 2-(2-hydroxy-3-nitrophenyl)propanal IUPAC Name: 2-(2-hydroxy-3-nitrophenyl)propanal Traditional Name: 2-(2-hydroxy-3-nitro-phenyl)propionaldehyde Formula: C9H9NO4 MolecularWeight: 195.17206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9NO4/c1-6(5-11)7-3-2-4-8(9(7)12)10(13)14/h2-6,12H,1H3