3-methyl-3-[(2,4,6-trimethoxyphenyl)methylsulfanyl]butanoic acid

Systemtic Name: 3-methyl-3-[(2,4,6-trimethoxyphenyl)methylsulfanyl]butanoic acid Openeye Name: 3-methyl-3-[(2,4,6-trimethoxyphenyl)methylsulfanyl]butanoic acid CAS Name: 3-methyl-3-[(2,4,6-trimethoxyphenyl)methylthio]butanoic acid IUPAC Name: 3-methyl-3-[(2,4,6-trimethoxyphenyl)methylsulfanyl]butanoic acid Traditional Name: 3-methyl-3-[(2,4,6-trimethoxybenzyl)thio]butyric acid Formula: C15H22O5S MolecularWeight: 314.39718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)O)SCC1=C(C=C(C=C1OC)OC)OC

Isomeric SMILES

CC(C)(CC(=O)O)SCC1=C(C=C(C=C1OC)OC)OC

InChI

InChI=1S/C15H22O5S/c1-15(2,8-14(16)17)21-9-11-12(19-4)6-10(18-3)7-13(11)20-5/h6-7H,8-9H2,1-5H3,(H,16,17)