4-(4-heptylcyclohexa-1,5-dien-1-yl)benzenecarbonitrile

Systemtic Name: 4-(4-heptylcyclohexa-1,5-dien-1-yl)benzenecarbonitrile Openeye Name: 4-(4-heptylcyclohexa-1,5-dien-1-yl)benzonitrile CAS Name: 4-(4-heptyl-1-cyclohexa-1,5-dienyl)benzonitrile IUPAC Name: 4-(4-heptylcyclohexa-1,5-dien-1-yl)benzonitrile Traditional Name: 4-(4-heptylcyclohexa-1,5-dien-1-yl)benzonitrile Formula: C20H25N MolecularWeight: 279.4192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CC=C(C=C1)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCCCC1CC=C(C=C1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C20H25N/c1-2-3-4-5-6-7-17-8-12-19(13-9-17)20-14-10-18(16-21)11-15-20/h8,10-15,17H,2-7,9H2,1H3