(3-dodecylsulfanyl-3-methyl-but-1-ynyl)benzene

Systemtic Name: (3-dodecylsulfanyl-3-methyl-but-1-ynyl)benzene Openeye Name: (3-dodecylsulfanyl-3-methyl-but-1-ynyl)benzene CAS Name: [3-(dodecylthio)-3-methylbut-1-ynyl]benzene IUPAC Name: (3-dodecylsulfanyl-3-methylbut-1-ynyl)benzene Traditional Name: [3-(laurylthio)-3-methyl-but-1-ynyl]benzene Formula: C23H36S MolecularWeight: 344.59694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(C)(C)C#CC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCSC(C)(C)C#CC1=CC=CC=C1

InChI

InChI=1S/C23H36S/c1-4-5-6-7-8-9-10-11-12-16-21-24-23(2,3)20-19-22-17-14-13-15-18-22/h13-15,17-18H,4-12,16,21H2,1-3H3