2-chloranyl-2-[2-(4-ethoxyphenyl)sulfanylphenyl]ethanoic acid

Systemtic Name: 2-chloranyl-2-[2-(4-ethoxyphenyl)sulfanylphenyl]ethanoic acid Openeye Name: 2-chloro-2-[2-(4-ethoxyphenyl)sulfanylphenyl]acetic acid CAS Name: 2-chloro-2-[2-[(4-ethoxyphenyl)thio]phenyl]acetic acid IUPAC Name: 2-chloro-2-[2-(4-ethoxyphenyl)sulfanylphenyl]acetic acid Traditional Name: 2-chloro-2-[2-(p-phenetylthio)phenyl]acetic acid Formula: C16H15ClO3S MolecularWeight: 322.8065

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)SC2=CC=CC=C2C(C(=O)O)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)SC2=CC=CC=C2C(C(=O)O)Cl

InChI

InChI=1S/C16H15ClO3S/c1-2-20-11-7-9-12(10-8-11)21-14-6-4-3-5-13(14)15(17)16(18)19/h3-10,15H,2H2,1H3,(H,18,19)