(4-bromanyl-2-chloranyl-phenyl) 2-(diphenylmethyl)sulfanylethanoate

Systemtic Name: (4-bromanyl-2-chloranyl-phenyl) 2-(diphenylmethyl)sulfanylethanoate Openeye Name: (4-bromo-2-chloro-phenyl) 2-benzhydrylsulfanylacetate CAS Name: 2-[(diphenylmethyl)thio]acetic acid (4-bromo-2-chlorophenyl) ester IUPAC Name: (4-bromo-2-chlorophenyl) 2-benzhydrylsulfanylacetate Traditional Name: 2-(benzhydrylthio)acetic acid (4-bromo-2-chloro-phenyl) ester Formula: C21H16BrClO2S MolecularWeight: 447.77254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16BrClO2S/c22-17-11-12-19(18(23)13-17)25-20(24)14-26-21(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13,21H,14H2