1-butyl-2-hex-1-ynyl-5-methyl-3-prop-1-en-2-yl-benzene

Systemtic Name: 1-butyl-2-hex-1-ynyl-5-methyl-3-prop-1-en-2-yl-benzene Openeye Name: 1-butyl-2-hex-1-ynyl-3-isopropenyl-5-methyl-benzene CAS Name: 1-butyl-2-hex-1-ynyl-5-methyl-3-(1-methylethenyl)benzene IUPAC Name: 1-butyl-2-hex-1-ynyl-5-methyl-3-prop-1-en-2-ylbenzene Traditional Name: 1-butyl-2-hex-1-ynyl-3-isopropenyl-5-methyl-benzene Formula: C20H28 MolecularWeight: 268.43632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=C(C=C(C=C1C(=C)C)C)CCCC

Isomeric SMILES

CCCCC#CC1=C(C=C(C=C1C(=C)C)C)CCCC

InChI

InChI=1S/C20H28/c1-6-8-10-11-13-19-18(12-9-7-2)14-17(5)15-20(19)16(3)4/h14-15H,3,6-10,12H2,1-2,4-5H3