2-deuteriooctan-2-ylsulfanylbenzene

Systemtic Name: 2-deuteriooctan-2-ylsulfanylbenzene Openeye Name: (1-deuterio-1-methyl-heptyl)sulfanylbenzene CAS Name: (2-deuteriooctan-2-ylthio)benzene IUPAC Name: 2-deuteriooctan-2-ylsulfanylbenzene Traditional Name: [(1-deuterio-1-methyl-heptyl)thio]benzene Formula: C14H22S MolecularWeight: 223.395642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)SC1=CC=CC=C1

Isomeric SMILES

[2H]C(C)(CCCCCC)SC1=CC=CC=C1

InChI

InChI=1S/C14H22S/c1-3-4-5-7-10-13(2)15-14-11-8-6-9-12-14/h6,8-9,11-13H,3-5,7,10H2,1-2H3/i13D