(E)-3-(2,4,5,6-tetradeuteriopyridin-3-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(2,4,5,6-tetradeuteriopyridin-3-yl)prop-2-enenitrile Openeye Name: (E)-3-(2,4,5,6-tetradeuterio-3-pyridyl)prop-2-enenitrile CAS Name: (E)-3-(2,4,5,6-tetradeuterio-3-pyridinyl)-2-propenenitrile IUPAC Name: (E)-3-(2,4,5,6-tetradeuteriopyridin-3-yl)prop-2-enenitrile Traditional Name: (E)-3-(2,4,5,6-tetradeuterio-3-pyridyl)acrylonitrile Formula: C8H6N2 MolecularWeight: 134.171287

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H6N2/c9-5-1-3-8-4-2-6-10-7-8/h1-4,6-7H/b3-1+/i2D,4D,6D,7D