5-bromanyl-2-[(4-chlorophenyl)methylsulfanyl]benzoic acid

Systemtic Name: 5-bromanyl-2-[(4-chlorophenyl)methylsulfanyl]benzoic acid Openeye Name: 5-bromo-2-[(4-chlorophenyl)methylsulfanyl]benzoic acid CAS Name: 5-bromo-2-[(4-chlorophenyl)methylthio]benzoic acid IUPAC Name: 5-bromo-2-[(4-chlorophenyl)methylsulfanyl]benzoic acid Traditional Name: 5-bromo-2-[(4-chlorobenzyl)thio]benzoic acid Formula: C14H10BrClO2S MolecularWeight: 357.65

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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