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2-butanoylsulfanyl-2-[4-(2-chlorophenyl)phenyl]propanoic acid

2-butanoylsulfanyl-2-[4-(2-chlorophenyl)phenyl]propanoic acid

Systemtic Name:2-butanoylsulfanyl-2-[4-(2-chlorophenyl)phenyl]propanoic acid
Openeye Name:2-butanoylsulfanyl-2-[4-(2-chlorophenyl)phenyl]propanoic acid
CAS Name:2-[4-(2-chlorophenyl)phenyl]-2-(1-oxobutylthio)propanoic acid
IUPAC Name:2-butanoylsulfanyl-2-[4-(2-chlorophenyl)phenyl]propanoic acid
Traditional Name:2-(butyrylthio)-2-[4-(2-chlorophenyl)phenyl]propionic acid
Formula: C19H19ClO3S
MolecularWeight: 362.87036
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)SC(C)(C1=CC=C(C=C1)C2=CC=CC=C2Cl)C(=O)O


Isomeric SMILES

CCCC(=O)SC(C)(C1=CC=C(C=C1)C2=CC=CC=C2Cl)C(=O)O


InChI

InChI=1S/C19H19ClO3S/c1-3-6-17(21)24-19(2,18(22)23)14-11-9-13(10-12-14)15-7-4-5-8-16(15)20/h4-5,7-12H,3,6H2,1-2H3,(H,22,23)


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