(4-bromanyl-2-chloranyl-phenyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate

Systemtic Name: (4-bromanyl-2-chloranyl-phenyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate Openeye Name: (4-bromo-2-chloro-phenyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate CAS Name: 4-[[(4-chlorophenyl)thio]methyl]benzoic acid (4-bromo-2-chlorophenyl) ester IUPAC Name: (4-bromo-2-chlorophenyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate Traditional Name: 4-[[(4-chlorophenyl)thio]methyl]benzoic acid (4-bromo-2-chloro-phenyl) ester Formula: C20H13BrCl2O2S MolecularWeight: 468.19102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=CC=C(C=C2)Cl)C(=O)OC3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1CSC2=CC=C(C=C2)Cl)C(=O)OC3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C20H13BrCl2O2S/c21-15-5-10-19(18(23)11-15)25-20(24)14-3-1-13(2-4-14)12-26-17-8-6-16(22)7-9-17/h1-11H,12H2