methyl 3-(2-chlorophenyl)-2-ethanoyl-4-[(R)-(4-methylphenyl)sulfinyl]-5-oxidanylidene-hexanoate

Systemtic Name: methyl 3-(2-chlorophenyl)-2-ethanoyl-4-[(R)-(4-methylphenyl)sulfinyl]-5-oxidanylidene-hexanoate Openeye Name: methyl 2-acetyl-3-(2-chlorophenyl)-5-oxo-4-[(R)-p-tolylsulfinyl]hexanoate CAS Name: 2-acetyl-3-(2-chlorophenyl)-4-[(R)-(4-methylphenyl)sulfinyl]-5-oxohexanoic acid methyl ester IUPAC Name: methyl 2-acetyl-3-(2-chlorophenyl)-4-[(R)-(4-methylphenyl)sulfinyl]-5-oxohexanoate Traditional Name: 2-acetyl-3-(2-chlorophenyl)-5-keto-4-[(R)-p-tolylsulfinyl]hexanoic acid methyl ester Formula: C22H23ClO5S MolecularWeight: 434.93302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)C(C(C2=CC=CC=C2Cl)C(C(=O)C)C(=O)OC)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)[S@](=O)C(C(C2=CC=CC=C2Cl)C(C(=O)C)C(=O)OC)C(=O)C

InChI

InChI=1S/C22H23ClO5S/c1-13-9-11-16(12-10-13)29(27)21(15(3)25)20(17-7-5-6-8-18(17)23)19(14(2)24)22(26)28-4/h5-12,19-21H,1-4H3/t19?,20?,21?,29-/m0/s1