5-methyl-4-[[4-(2-methylsulfanylphenyl)phenoxy]methyl]furan-2-carboxylic acid

Systemtic Name: 5-methyl-4-[[4-(2-methylsulfanylphenyl)phenoxy]methyl]furan-2-carboxylic acid Openeye Name: 5-methyl-4-[[4-(2-methylsulfanylphenyl)phenoxy]methyl]furan-2-carboxylic acid CAS Name: 5-methyl-4-[[4-[2-(methylthio)phenyl]phenoxy]methyl]-2-furancarboxylic acid IUPAC Name: 5-methyl-4-[[4-(2-methylsulfanylphenyl)phenoxy]methyl]furan-2-carboxylic acid Traditional Name: 5-methyl-4-[[4-[2-(methylthio)phenyl]phenoxy]methyl]-2-furoic acid Formula: C20H18O4S MolecularWeight: 354.41952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)O)COC2=CC=C(C=C2)C3=CC=CC=C3SC

Isomeric SMILES

CC1=C(C=C(O1)C(=O)O)COC2=CC=C(C=C2)C3=CC=CC=C3SC

InChI

InChI=1S/C20H18O4S/c1-13-15(11-18(24-13)20(21)22)12-23-16-9-7-14(8-10-16)17-5-3-4-6-19(17)25-2/h3-11H,12H2,1-2H3,(H,21,22)