(E)-2,2,8-trimethyl-9-naphthalen-1-yl-non-5-en-3-ynenitrile

Systemtic Name: (E)-2,2,8-trimethyl-9-naphthalen-1-yl-non-5-en-3-ynenitrile Openeye Name: (E)-2,2,8-trimethyl-9-(1-naphthyl)non-5-en-3-ynenitrile CAS Name: (E)-2,2,8-trimethyl-9-(1-naphthalenyl)non-5-en-3-ynenitrile IUPAC Name: (E)-2,2,8-trimethyl-9-naphthalen-1-ylnon-5-en-3-ynenitrile Traditional Name: (E)-2,2,8-trimethyl-9-(1-naphthyl)non-5-en-3-ynenitrile Formula: C22H23N MolecularWeight: 301.42472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC=CC#CC(C)(C)C#N)CC1=CC=CC2=CC=CC=C21

Isomeric SMILES

CC(C/C=C/C#CC(C)(C)C#N)CC1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C22H23N/c1-18(10-5-4-8-15-22(2,3)17-23)16-20-13-9-12-19-11-6-7-14-21(19)20/h4-7,9,11-14,18H,10,16H2,1-3H3/b5-4+