4-[(1E)-4,4-dicyano-2-methyl-buta-1,3-dienyl]-N-oxidanyl-benzeneamine oxide

Systemtic Name: 4-[(1E)-4,4-dicyano-2-methyl-buta-1,3-dienyl]-N-oxidanyl-benzeneamine oxide Openeye Name: 4-[(1E)-4,4-dicyano-2-methyl-buta-1,3-dienyl]-N-hydroxy-benzeneamine oxide CAS Name: 4-[(1E)-4,4-dicyano-2-methylbuta-1,3-dienyl]-N-hydroxybenzeneamine oxide IUPAC Name: 4-[(1E)-4,4-dicyano-2-methylbuta-1,3-dienyl]-N-hydroxybenzeneamine oxide Traditional Name: 4-[(1E)-4,4-dicyano-2-methyl-buta-1,3-dienyl]-N-hydroxy-benzeneamine oxide Formula: C13H11N3O2 MolecularWeight: 241.24534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11N3O2/c1-10(7-12(8-14)9-15)6-11-2-4-13(5-3-11)16(17)18/h2-7,16-17H,1H3/b10-6+