2-[(3E)-3-[(E)-4,4-dimethyl-1-phenyl-pent-2-enylidene]-1-methyl-cyclopentyl]ethanenitrile

Systemtic Name: 2-[(3E)-3-[(E)-4,4-dimethyl-1-phenyl-pent-2-enylidene]-1-methyl-cyclopentyl]ethanenitrile Openeye Name: 2-[(3E)-3-[(E)-4,4-dimethyl-1-phenyl-pent-2-enylidene]-1-methyl-cyclopentyl]acetonitrile CAS Name: 2-[(3E)-3-[(E)-4,4-dimethyl-1-phenylpent-2-enylidene]-1-methylcyclopentyl]acetonitrile IUPAC Name: 2-[(3E)-3-[(E)-4,4-dimethyl-1-phenylpent-2-enylidene]-1-methylcyclopentyl]acetonitrile Traditional Name: 2-[(3E)-3-[(E)-4,4-dimethyl-1-phenyl-pent-2-enylidene]-1-methyl-cyclopentyl]acetonitrile Formula: C21H27N MolecularWeight: 293.44578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=C(C=CC(C)(C)C)C2=CC=CC=C2)C1)CC#N

Isomeric SMILES

CC1(CC/C(=C(/C=C/C(C)(C)C)\C2=CC=CC=C2)/C1)CC#N

InChI

InChI=1S/C21H27N/c1-20(2,3)12-11-19(17-8-6-5-7-9-17)18-10-13-21(4,16-18)14-15-22/h5-9,11-12H,10,13-14,16H2,1-4H3/b12-11+,19-18+