2-[4-(2-bromophenyl)phenyl]-2-propanoylsulfanyl-ethanoic acid

Systemtic Name: 2-[4-(2-bromophenyl)phenyl]-2-propanoylsulfanyl-ethanoic acid Openeye Name: 2-[4-(2-bromophenyl)phenyl]-2-propanoylsulfanyl-acetic acid CAS Name: 2-[4-(2-bromophenyl)phenyl]-2-(1-oxopropylthio)acetic acid IUPAC Name: 2-[4-(2-bromophenyl)phenyl]-2-propanoylsulfanylacetic acid Traditional Name: 2-[4-(2-bromophenyl)phenyl]-2-(propionylthio)acetic acid Formula: C17H15BrO3S MolecularWeight: 379.2682

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)SC(C1=CC=C(C=C1)C2=CC=CC=C2Br)C(=O)O

Isomeric SMILES

CCC(=O)SC(C1=CC=C(C=C1)C2=CC=CC=C2Br)C(=O)O

InChI

InChI=1S/C17H15BrO3S/c1-2-15(19)22-16(17(20)21)12-9-7-11(8-10-12)13-5-3-4-6-14(13)18/h3-10,16H,2H2,1H3,(H,20,21)