butyl 2-(4-bromanyl-3-methyl-phenyl)sulfanyl-2-methyl-propanoate

Systemtic Name: butyl 2-(4-bromanyl-3-methyl-phenyl)sulfanyl-2-methyl-propanoate Openeye Name: butyl 2-(4-bromo-3-methyl-phenyl)sulfanyl-2-methyl-propanoate CAS Name: 2-[(4-bromo-3-methylphenyl)thio]-2-methylpropanoic acid butyl ester IUPAC Name: butyl 2-(4-bromo-3-methylphenyl)sulfanyl-2-methylpropanoate Traditional Name: 2-[(4-bromo-3-methyl-phenyl)thio]-2-methyl-propionic acid butyl ester Formula: C15H21BrO2S MolecularWeight: 345.29504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C)(C)SC1=CC(=C(C=C1)Br)C

Isomeric SMILES

CCCCOC(=O)C(C)(C)SC1=CC(=C(C=C1)Br)C

InChI

InChI=1S/C15H21BrO2S/c1-5-6-9-18-14(17)15(3,4)19-12-7-8-13(16)11(2)10-12/h7-8,10H,5-6,9H2,1-4H3