3-bromanyl-5-[(4-chlorophenyl)methylsulfanyl]benzoic acid

Systemtic Name: 3-bromanyl-5-[(4-chlorophenyl)methylsulfanyl]benzoic acid Openeye Name: 3-bromo-5-[(4-chlorophenyl)methylsulfanyl]benzoic acid CAS Name: 3-bromo-5-[(4-chlorophenyl)methylthio]benzoic acid IUPAC Name: 3-bromo-5-[(4-chlorophenyl)methylsulfanyl]benzoic acid Traditional Name: 3-bromo-5-[(4-chlorobenzyl)thio]benzoic acid Formula: C14H10BrClO2S MolecularWeight: 357.65

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=CC(=CC(=C2)C(=O)O)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1CSC2=CC(=CC(=C2)C(=O)O)Br)Cl

InChI

InChI=1S/C14H10BrClO2S/c15-11-5-10(14(17)18)6-13(7-11)19-8-9-1-3-12(16)4-2-9/h1-7H,8H2,(H,17,18)