2,5,5-trideuterio-2-methyl-cyclohex-3-ene-1-carbonitrile

Systemtic Name: 2,5,5-trideuterio-2-methyl-cyclohex-3-ene-1-carbonitrile Openeye Name: 2,5,5-trideuterio-2-methyl-cyclohex-3-ene-1-carbonitrile CAS Name: 2,5,5-trideuterio-2-methyl-1-cyclohex-3-enecarbonitrile IUPAC Name: 2,5,5-trideuterio-2-methylcyclohex-3-ene-1-carbonitrile Traditional Name: 2,5,5-trideuterio-2-methyl-cyclohex-3-ene-1-carbonitrile Formula: C8H11N MolecularWeight: 124.198125

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CCCC1C#N

Isomeric SMILES

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

InChI

InChI=1S/C8H11N/c1-7-4-2-3-5-8(7)6-9/h2,4,7-8H,3,5H2,1H3/i3D2,7D