2-[4-[(3-ethoxyphenyl)sulfanylmethyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[(3-ethoxyphenyl)sulfanylmethyl]phenyl]ethanoic acid Openeye Name: 2-[4-[(3-ethoxyphenyl)sulfanylmethyl]phenyl]acetic acid CAS Name: 2-[4-[[(3-ethoxyphenyl)thio]methyl]phenyl]acetic acid IUPAC Name: 2-[4-[(3-ethoxyphenyl)sulfanylmethyl]phenyl]acetic acid Traditional Name: 2-[4-[(m-phenetylthio)methyl]phenyl]acetic acid Formula: C17H18O3S MolecularWeight: 302.38802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC=C1)SCC2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

CCOC1=CC(=CC=C1)SCC2=CC=C(C=C2)CC(=O)O

InChI

InChI=1S/C17H18O3S/c1-2-20-15-4-3-5-16(11-15)21-12-14-8-6-13(7-9-14)10-17(18)19/h3-9,11H,2,10,12H2,1H3,(H,18,19)