5-methylbenzene-1,3-dicarbonitrile oxide

Systemtic Name: 5-methylbenzene-1,3-dicarbonitrile oxide Openeye Name: 5-methylbenzene-1,3-dicarbonitrile oxide CAS Name: 5-methylbenzene-1,3-dicarbonitrile oxide IUPAC Name: 5-methylbenzene-1,3-dicarbonitrile oxide Traditional Name: 5-methylbenzene-1,3-dicarbonitrile oxide Formula: C9H6N2O2 MolecularWeight: 174.15614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6N2O2/c1-7-2-8(5-10-12)4-9(3-7)6-11-13/h2-4H,1H3