2-(6-bromanylhexoxy)-4-methylsulfanyl-1-propyl-benzene

Systemtic Name: 2-(6-bromanylhexoxy)-4-methylsulfanyl-1-propyl-benzene Openeye Name: 2-(6-bromohexoxy)-4-methylsulfanyl-1-propyl-benzene CAS Name: 2-(6-bromohexoxy)-4-(methylthio)-1-propylbenzene IUPAC Name: 2-(6-bromohexoxy)-4-methylsulfanyl-1-propylbenzene Traditional Name: 2-(6-bromohexoxy)-4-(methylthio)-1-propyl-benzene Formula: C16H25BrOS MolecularWeight: 345.3381

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C=C1)SC)OCCCCCCBr

Isomeric SMILES

CCCC1=C(C=C(C=C1)SC)OCCCCCCBr

InChI

InChI=1S/C16H25BrOS/c1-3-8-14-9-10-15(19-2)13-16(14)18-12-7-5-4-6-11-17/h9-10,13H,3-8,11-12H2,1-2H3