1-ethynyl-4-[(E)-3-methylsulfanylbut-2-enoxy]benzene

Systemtic Name: 1-ethynyl-4-[(E)-3-methylsulfanylbut-2-enoxy]benzene Openeye Name: 1-ethynyl-4-[(E)-3-methylsulfanylbut-2-enoxy]benzene CAS Name: 1-ethynyl-4-[(E)-3-(methylthio)but-2-enoxy]benzene IUPAC Name: 1-ethynyl-4-[(E)-3-methylsulfanylbut-2-enoxy]benzene Traditional Name: 1-ethynyl-4-[(E)-3-(methylthio)but-2-enoxy]benzene Formula: C13H14OS MolecularWeight: 218.31466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC1=CC=C(C=C1)C#C)SC

Isomeric SMILES

C/C(=C\COC1=CC=C(C=C1)C#C)/SC

InChI

InChI=1S/C13H14OS/c1-4-12-5-7-13(8-6-12)14-10-9-11(2)15-3/h1,5-9H,10H2,2-3H3/b11-9+