3-isocyano-2,5,6-trimethyl-benzenecarbonitrile oxide

Systemtic Name: 3-isocyano-2,5,6-trimethyl-benzenecarbonitrile oxide Openeye Name: 3-isocyano-2,5,6-trimethyl-benzonitrile oxide CAS Name: 3-isocyano-2,5,6-trimethylbenzonitrile oxide IUPAC Name: 3-isocyano-2,5,6-trimethylbenzonitrile oxide Traditional Name: 3-isocyano-2,5,6-trimethyl-benzonitrile oxide Formula: C11H10N2O MolecularWeight: 186.2099

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10N2O/c1-7-5-11(12-4)9(3)10(6-13-14)8(7)2/h5H,1-3H3