(E)-2-isocyano-3-(2-methylphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-isocyano-3-(2-methylphenyl)prop-2-enenitrile Openeye Name: (E)-2-isocyano-3-(o-tolyl)prop-2-enenitrile CAS Name: (E)-2-isocyano-3-(2-methylphenyl)-2-propenenitrile IUPAC Name: (E)-2-isocyano-3-(2-methylphenyl)prop-2-enenitrile Traditional Name: (E)-2-isocyano-3-(o-tolyl)acrylonitrile Formula: C11H8N2 MolecularWeight: 168.19462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=C(C#N)[N+]#[C-]

Isomeric SMILES

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

InChI

InChI=1S/C11H8N2/c1-9-5-3-4-6-10(9)7-11(8-12)13-2/h3-7H,1H3/b11-7+