(phenylmethyl) 2-chloranyl-2-[4-(4-methylsulfonylphenyl)phenyl]ethanoate

Systemtic Name: (phenylmethyl) 2-chloranyl-2-[4-(4-methylsulfonylphenyl)phenyl]ethanoate Openeye Name: benzyl 2-chloro-2-[4-(4-methylsulfonylphenyl)phenyl]acetate CAS Name: 2-chloro-2-[4-(4-methylsulfonylphenyl)phenyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-chloro-2-[4-(4-methylsulfonylphenyl)phenyl]acetate Traditional Name: 2-chloro-2-[4-(4-mesylphenyl)phenyl]acetic acid benzyl ester Formula: C22H19ClO4S MolecularWeight: 414.90186

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C(C(=O)OCC3=CC=CC=C3)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C(C(=O)OCC3=CC=CC=C3)Cl

InChI

InChI=1S/C22H19ClO4S/c1-28(25,26)20-13-11-18(12-14-20)17-7-9-19(10-8-17)21(23)22(24)27-15-16-5-3-2-4-6-16/h2-14,21H,15H2,1H3