2-[4-(4-methanoylphenyl)sulfanyl-2-methyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-(4-methanoylphenyl)sulfanyl-2-methyl-phenoxy]ethanoic acid Openeye Name: 2-[4-(4-formylphenyl)sulfanyl-2-methyl-phenoxy]acetic acid CAS Name: 2-[4-[(4-formylphenyl)thio]-2-methylphenoxy]acetic acid IUPAC Name: 2-[4-(4-formylphenyl)sulfanyl-2-methylphenoxy]acetic acid Traditional Name: 2-[4-[(4-formylphenyl)thio]-2-methyl-phenoxy]acetic acid Formula: C16H14O4S MolecularWeight: 302.34496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SC2=CC=C(C=C2)C=O)OCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)SC2=CC=C(C=C2)C=O)OCC(=O)O

InChI

InChI=1S/C16H14O4S/c1-11-8-14(6-7-15(11)20-10-16(18)19)21-13-4-2-12(9-17)3-5-13/h2-9H,10H2,1H3,(H,18,19)