(3E)-3-[(2-azidophenyl)methylidene]-4-oxidanylidene-pentanenitrile

Systemtic Name: (3E)-3-[(2-azidophenyl)methylidene]-4-oxidanylidene-pentanenitrile Openeye Name: (3E)-3-[(2-azidophenyl)methylene]-4-oxo-pentanenitrile CAS Name: (3E)-3-[(2-azidophenyl)methylidene]-4-oxopentanenitrile IUPAC Name: (3E)-3-[(2-azidophenyl)methylidene]-4-oxopentanenitrile Traditional Name: (E)-3-acetyl-4-(2-azidophenyl)but-3-enenitrile Formula: C12H10N4O MolecularWeight: 226.234

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC=CC=C1N=[N+]=[N-])CC#N

Isomeric SMILES

CC(=O)/C(=C/C1=CC=CC=C1N=[N+]=[N-])/CC#N

InChI

InChI=1S/C12H10N4O/c1-9(17)10(6-7-13)8-11-4-2-3-5-12(11)15-16-14/h2-5,8H,6H2,1H3/b10-8+