2-[4-[(3,4-dimethylphenyl)methylsulfanyl]-2,5-dimethyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(3,4-dimethylphenyl)methylsulfanyl]-2,5-dimethyl-phenoxy]ethanoic acid Openeye Name: 2-[4-[(3,4-dimethylphenyl)methylsulfanyl]-2,5-dimethyl-phenoxy]acetic acid CAS Name: 2-[4-[(3,4-dimethylphenyl)methylthio]-2,5-dimethylphenoxy]acetic acid IUPAC Name: 2-[4-[(3,4-dimethylphenyl)methylsulfanyl]-2,5-dimethylphenoxy]acetic acid Traditional Name: 2-[4-[(3,4-dimethylbenzyl)thio]-2,5-dimethyl-phenoxy]acetic acid Formula: C19H22O3S MolecularWeight: 330.44118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CSC2=CC(=C(C=C2C)OCC(=O)O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)CSC2=CC(=C(C=C2C)OCC(=O)O)C)C

InChI

InChI=1S/C19H22O3S/c1-12-5-6-16(7-13(12)2)11-23-18-9-14(3)17(8-15(18)4)22-10-19(20)21/h5-9H,10-11H2,1-4H3,(H,20,21)