3-(2-ethanoyl-3-oxidanylidene-but-1-enyl)-N-oxidanyl-benzeneamine oxide

Systemtic Name: 3-(2-ethanoyl-3-oxidanylidene-but-1-enyl)-N-oxidanyl-benzeneamine oxide Openeye Name: 3-(2-acetyl-3-oxo-but-1-enyl)-N-hydroxy-benzeneamine oxide CAS Name: 3-(2-acetyl-3-oxobut-1-enyl)-N-hydroxybenzeneamine oxide IUPAC Name: 3-(2-acetyl-3-oxobut-1-enyl)-N-hydroxybenzeneamine oxide Traditional Name: 3-(2-acetyl-3-keto-but-1-enyl)-N-hydroxy-benzeneamine oxide Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC(=CC=C1)[NH+](O)[O-])C(=O)C

Isomeric SMILES

CC(=O)C(=CC1=CC(=CC=C1)[NH+](O)[O-])C(=O)C

InChI

InChI=1S/C12H13NO4/c1-8(14)12(9(2)15)7-10-4-3-5-11(6-10)13(16)17/h3-7,13,16H,1-2H3