2-butoxy-5-(2-methylheptan-2-yl)benzenethiol

Systemtic Name: 2-butoxy-5-(2-methylheptan-2-yl)benzenethiol Openeye Name: 2-butoxy-5-(1,1-dimethylhexyl)benzenethiol CAS Name: 2-butoxy-5-(2-methylheptan-2-yl)benzenethiol IUPAC Name: 2-butoxy-5-(2-methylheptan-2-yl)benzenethiol Traditional Name: 2-butoxy-5-(1,1-dimethylhexyl)benzenethiol Formula: C18H30OS MolecularWeight: 294.4952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)C1=CC(=C(C=C1)OCCCC)S

Isomeric SMILES

CCCCCC(C)(C)C1=CC(=C(C=C1)OCCCC)S

InChI

InChI=1S/C18H30OS/c1-5-7-9-12-18(3,4)15-10-11-16(17(20)14-15)19-13-8-6-2/h10-11,14,20H,5-9,12-13H2,1-4H3