(E)-5-(2,6,6-trimethylcyclohexen-1-yl)pent-4-en-2-ynenitrile

Systemtic Name: (E)-5-(2,6,6-trimethylcyclohexen-1-yl)pent-4-en-2-ynenitrile Openeye Name: (E)-5-(2,6,6-trimethylcyclohexen-1-yl)pent-4-en-2-ynenitrile CAS Name: (E)-5-(2,6,6-trimethyl-1-cyclohexenyl)pent-4-en-2-ynenitrile IUPAC Name: (E)-5-(2,6,6-trimethylcyclohexen-1-yl)pent-4-en-2-ynenitrile Traditional Name: (E)-5-(2,6,6-trimethylcyclohexen-1-yl)pent-4-en-2-ynenitrile Formula: C14H17N MolecularWeight: 199.29148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)C=CC#CC#N

Isomeric SMILES

CC1=C(C(CCC1)(C)C)/C=C/C#CC#N

InChI

InChI=1S/C14H17N/c1-12-8-7-10-14(2,3)13(12)9-5-4-6-11-15/h5,9H,7-8,10H2,1-3H3/b9-5+