2-[4-(4-methanoyl-2-methyl-phenyl)sulfanyl-2,5-dimethyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-(4-methanoyl-2-methyl-phenyl)sulfanyl-2,5-dimethyl-phenoxy]ethanoic acid Openeye Name: 2-[4-(4-formyl-2-methyl-phenyl)sulfanyl-2,5-dimethyl-phenoxy]acetic acid CAS Name: 2-[4-[(4-formyl-2-methylphenyl)thio]-2,5-dimethylphenoxy]acetic acid IUPAC Name: 2-[4-(4-formyl-2-methylphenyl)sulfanyl-2,5-dimethylphenoxy]acetic acid Traditional Name: 2-[4-[(4-formyl-2-methyl-phenyl)thio]-2,5-dimethyl-phenoxy]acetic acid Formula: C18H18O4S MolecularWeight: 330.39812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1SC2=C(C=C(C=C2)C=O)C)C)OCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1SC2=C(C=C(C=C2)C=O)C)C)OCC(=O)O

InChI

InChI=1S/C18H18O4S/c1-11-8-17(13(3)7-15(11)22-10-18(20)21)23-16-5-4-14(9-19)6-12(16)2/h4-9H,10H2,1-3H3,(H,20,21)