1,3,5-trimethyl-2-(2-phenylethynyl)benzene

Systemtic Name: 1,3,5-trimethyl-2-(2-phenylethynyl)benzene Openeye Name: 1,3,5-trimethyl-2-(2-phenylethynyl)benzene CAS Name: 1,3,5-trimethyl-2-(2-phenylethynyl)benzene IUPAC Name: 1,3,5-trimethyl-2-(2-phenylethynyl)benzene Traditional Name: 1,3,5-trimethyl-2-(2-phenylethynyl)benzene Formula: C17H16 MolecularWeight: 220.30894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C#CC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C#CC2=CC=CC=C2)C

InChI

InChI=1S/C17H16/c1-13-11-14(2)17(15(3)12-13)10-9-16-7-5-4-6-8-16/h4-8,11-12H,1-3H3