(phenylmethyl) 2-chloranyl-2-[4-(4-methylsulfinylphenyl)phenyl]propanoate

Systemtic Name: (phenylmethyl) 2-chloranyl-2-[4-(4-methylsulfinylphenyl)phenyl]propanoate Openeye Name: benzyl 2-chloro-2-[4-(4-methylsulfinylphenyl)phenyl]propanoate CAS Name: 2-chloro-2-[4-(4-methylsulfinylphenyl)phenyl]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-chloro-2-[4-(4-methylsulfinylphenyl)phenyl]propanoate Traditional Name: 2-chloro-2-[4-(4-methylsulfinylphenyl)phenyl]propionic acid benzyl ester Formula: C23H21ClO3S MolecularWeight: 412.92904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21ClO3S/c1-23(24,22(25)27-16-17-6-4-3-5-7-17)20-12-8-18(9-13-20)19-10-14-21(15-11-19)28(2)26/h3-15H,16H2,1-2H3