2-(2-methylphenoxy)-2-phenethylsulfanyl-2-(2H-pyran-6-yl)ethanoic acid

Systemtic Name: 2-(2-methylphenoxy)-2-phenethylsulfanyl-2-(2H-pyran-6-yl)ethanoic acid Openeye Name: 2-(2-methylphenoxy)-2-phenethylsulfanyl-2-(2H-pyran-6-yl)acetic acid CAS Name: 2-(2-methylphenoxy)-2-(phenethylthio)-2-(2H-pyran-6-yl)acetic acid IUPAC Name: 2-(2-methylphenoxy)-2-phenethylsulfanyl-2-(2H-pyran-6-yl)acetic acid Traditional Name: 2-(2-methylphenoxy)-2-(phenethylthio)-2-(2H-pyran-6-yl)acetic acid Formula: C22H22O4S MolecularWeight: 382.47268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC(C2=CC=CCO2)(C(=O)O)SCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1OC(C2=CC=CCO2)(C(=O)O)SCCC3=CC=CC=C3

InChI

InChI=1S/C22H22O4S/c1-17-9-5-6-12-19(17)26-22(21(23)24,20-13-7-8-15-25-20)27-16-14-18-10-3-2-4-11-18/h2-13H,14-16H2,1H3,(H,23,24)