1-bromanyl-4-octan-2-ylsulfanyl-benzene

Systemtic Name: 1-bromanyl-4-octan-2-ylsulfanyl-benzene Openeye Name: 1-bromo-4-(1-methylheptylsulfanyl)benzene CAS Name: 1-bromo-4-(octan-2-ylthio)benzene IUPAC Name: 1-bromo-4-octan-2-ylsulfanylbenzene Traditional Name: 1-bromo-4-(1-methylheptylthio)benzene Formula: C14H21BrS MolecularWeight: 301.28554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)SC1=CC=C(C=C1)Br

Isomeric SMILES

CCCCCCC(C)SC1=CC=C(C=C1)Br

InChI

InChI=1S/C14H21BrS/c1-3-4-5-6-7-12(2)16-14-10-8-13(15)9-11-14/h8-12H,3-7H2,1-2H3