4-[(E)-4,4-dimethyl-3-oxidanylidene-pent-1-enyl]-N-oxidanyl-benzeneamine oxide

Systemtic Name: 4-[(E)-4,4-dimethyl-3-oxidanylidene-pent-1-enyl]-N-oxidanyl-benzeneamine oxide Openeye Name: 4-[(E)-4,4-dimethyl-3-oxo-pent-1-enyl]-N-hydroxy-benzeneamine oxide CAS Name: 4-[(E)-4,4-dimethyl-3-oxopent-1-enyl]-N-hydroxybenzeneamine oxide IUPAC Name: 4-[(E)-4,4-dimethyl-3-oxopent-1-enyl]-N-hydroxybenzeneamine oxide Traditional Name: N-hydroxy-4-[(E)-3-keto-4,4-dimethyl-pent-1-enyl]benzeneamine oxide Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO3/c1-13(2,3)12(15)9-6-10-4-7-11(8-5-10)14(16)17/h4-9,14,16H,1-3H3/b9-6+