butyl 2-methyl-2-(2-methylphenyl)sulfanyl-propanoate

Systemtic Name: butyl 2-methyl-2-(2-methylphenyl)sulfanyl-propanoate Openeye Name: butyl 2-methyl-2-(o-tolylsulfanyl)propanoate CAS Name: 2-methyl-2-[(2-methylphenyl)thio]propanoic acid butyl ester IUPAC Name: butyl 2-methyl-2-(2-methylphenyl)sulfanylpropanoate Traditional Name: 2-methyl-2-(o-tolylthio)propionic acid butyl ester Formula: C15H22O2S MolecularWeight: 266.39898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C)(C)SC1=CC=CC=C1C

Isomeric SMILES

CCCCOC(=O)C(C)(C)SC1=CC=CC=C1C

InChI

InChI=1S/C15H22O2S/c1-5-6-11-17-14(16)15(3,4)18-13-10-8-7-9-12(13)2/h7-10H,5-6,11H2,1-4H3