(E)-N,6,6-trimethyl-N-[2-(2-methylphenyl)prop-2-enyl]hept-2-en-4-yn-1-amine

Systemtic Name: (E)-N,6,6-trimethyl-N-[2-(2-methylphenyl)prop-2-enyl]hept-2-en-4-yn-1-amine Openeye Name: (E)-N,6,6-trimethyl-N-[2-(o-tolyl)allyl]hept-2-en-4-yn-1-amine CAS Name: (E)-N,6,6-trimethyl-N-[2-(2-methylphenyl)prop-2-enyl]-1-hept-2-en-4-ynamine IUPAC Name: (E)-N,6,6-trimethyl-N-[2-(2-methylphenyl)prop-2-enyl]hept-2-en-4-yn-1-amine Traditional Name: [(E)-6,6-dimethylhept-2-en-4-ynyl]-methyl-[2-(o-tolyl)allyl]amine Formula: C20H27N MolecularWeight: 281.43508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=C)CN(C)CC=CC#CC(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1C(=C)CN(C)C/C=C/C#CC(C)(C)C

InChI

InChI=1S/C20H27N/c1-17-12-8-9-13-19(17)18(2)16-21(6)15-11-7-10-14-20(3,4)5/h7-9,11-13H,2,15-16H2,1,3-6H3/b11-7+