2-[[3-[2-(4-ethylphenyl)ethoxy]phenyl]methylsulfanyl]ethanoic acid

Systemtic Name: 2-[[3-[2-(4-ethylphenyl)ethoxy]phenyl]methylsulfanyl]ethanoic acid Openeye Name: 2-[[3-[2-(4-ethylphenyl)ethoxy]phenyl]methylsulfanyl]acetic acid CAS Name: 2-[[3-[2-(4-ethylphenyl)ethoxy]phenyl]methylthio]acetic acid IUPAC Name: 2-[[3-[2-(4-ethylphenyl)ethoxy]phenyl]methylsulfanyl]acetic acid Traditional Name: 2-[[3-[2-(4-ethylphenyl)ethoxy]benzyl]thio]acetic acid Formula: C19H22O3S MolecularWeight: 330.44118

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CCOC2=CC=CC(=C2)CSCC(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)CCOC2=CC=CC(=C2)CSCC(=O)O

InChI

InChI=1S/C19H22O3S/c1-2-15-6-8-16(9-7-15)10-11-22-18-5-3-4-17(12-18)13-23-14-19(20)21/h3-9,12H,2,10-11,13-14H2,1H3,(H,20,21)