(2E)-2-(2,2,4-trimethyl-3-oxabicyclo[2.2.2]octan-5-ylidene)ethanenitrile

Systemtic Name: (2E)-2-(2,2,4-trimethyl-3-oxabicyclo[2.2.2]octan-5-ylidene)ethanenitrile Openeye Name: (2E)-2-(2,2,4-trimethyl-3-oxabicyclo[2.2.2]octan-5-ylidene)acetonitrile CAS Name: (2E)-2-(2,2,4-trimethyl-3-oxabicyclo[2.2.2]octan-5-ylidene)acetonitrile IUPAC Name: (2E)-2-(2,2,4-trimethyl-3-oxabicyclo[2.2.2]octan-5-ylidene)acetonitrile Traditional Name: (2E)-2-(2,2,4-trimethyl-3-oxabicyclo[2.2.2]octan-5-ylidene)acetonitrile Formula: C12H17NO MolecularWeight: 191.26948

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC(O1)(C(=CC#N)C2)C)C

Isomeric SMILES

CC1(C2CCC(O1)(/C(=C/C#N)/C2)C)C

InChI

InChI=1S/C12H17NO/c1-11(2)9-4-6-12(3,14-11)10(8-9)5-7-13/h5,9H,4,6,8H2,1-3H3/b10-5+