2,6-dideuterio-4-methyl-benzenecarbonitrile

Systemtic Name: 2,6-dideuterio-4-methyl-benzenecarbonitrile Openeye Name: 2,6-dideuterio-4-methyl-benzonitrile CAS Name: 2,6-dideuterio-4-methylbenzonitrile IUPAC Name: 2,6-dideuterio-4-methylbenzonitrile Traditional Name: 2,6-dideuterio-4-methyl-benzonitrile Formula: C8H7N MolecularWeight: 119.160204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#N

Isomeric SMILES

[2H]C1=CC(=CC(=C1C#N)[2H])C

InChI

InChI=1S/C8H7N/c1-7-2-4-8(6-9)5-3-7/h2-5H,1H3/i4D,5D