2-[4-[ethanoylsulfanyl(phenyl)methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[ethanoylsulfanyl(phenyl)methyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[acetylsulfanyl(phenyl)methyl]phenoxy]acetic acid CAS Name: 2-[4-[(acetylthio)-phenylmethyl]phenoxy]acetic acid IUPAC Name: 2-[4-[acetylsulfanyl(phenyl)methyl]phenoxy]acetic acid Traditional Name: 2-[4-[(acetylthio)-phenyl-methyl]phenoxy]acetic acid Formula: C17H16O4S MolecularWeight: 316.37154

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(C1=CC=CC=C1)C2=CC=C(C=C2)OCC(=O)O

Isomeric SMILES

CC(=O)SC(C1=CC=CC=C1)C2=CC=C(C=C2)OCC(=O)O

InChI

InChI=1S/C17H16O4S/c1-12(18)22-17(13-5-3-2-4-6-13)14-7-9-15(10-8-14)21-11-16(19)20/h2-10,17H,11H2,1H3,(H,19,20)