(E)-2-isocyano-3-(4-methylphenyl)pent-2-enedinitrile

Systemtic Name: (E)-2-isocyano-3-(4-methylphenyl)pent-2-enedinitrile Openeye Name: (E)-2-isocyano-3-(p-tolyl)pent-2-enedinitrile CAS Name: (E)-2-isocyano-3-(4-methylphenyl)-2-pentenedinitrile IUPAC Name: (E)-2-isocyano-3-(4-methylphenyl)pent-2-enedinitrile Traditional Name: (E)-2-isocyano-3-(p-tolyl)pent-2-enedinitrile Formula: C13H9N3 MolecularWeight: 207.23066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)/C(=C(\C#N)/[N+]#[C-])/CC#N

InChI

InChI=1S/C13H9N3/c1-10-3-5-11(6-4-10)12(7-8-14)13(9-15)16-2/h3-6H,7H2,1H3/b13-12+