2-chloranyl-2-(2-phenylsulfanylphenyl)ethanoic acid; oxirane

Systemtic Name: 2-chloranyl-2-(2-phenylsulfanylphenyl)ethanoic acid; oxirane Openeye Name: 2-chloro-2-(2-phenylsulfanylphenyl)acetic acid; oxirane CAS Name: 2-chloro-2-[2-(phenylthio)phenyl]acetic acid; oxirane IUPAC Name: 2-chloro-2-(2-phenylsulfanylphenyl)acetic acid; oxirane Traditional Name: 2-chloro-2-[2-(phenylthio)phenyl]acetic acid; ethylene oxide Formula: C16H15ClO3S MolecularWeight: 322.8065

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Descriptors Computed from Structure

Canonical SMILES:

C1CO1.C1=CC=C(C=C1)SC2=CC=CC=C2C(C(=O)O)Cl

Isomeric SMILES

C1CO1.C1=CC=C(C=C1)SC2=CC=CC=C2C(C(=O)O)Cl

InChI

InChI=1S/C14H11ClO2S.C2H4O/c15-13(14(16)17)11-8-4-5-9-12(11)18-10-6-2-1-3-7-10;1-2-3-1/h1-9,13H,(H,16,17);1-2H2