(3-ethanoyl-2,4,6-trimethyl-phenyl)methyl 3-(methylsulfinylmethyl)benzoate

Systemtic Name: (3-ethanoyl-2,4,6-trimethyl-phenyl)methyl 3-(methylsulfinylmethyl)benzoate Openeye Name: (3-acetyl-2,4,6-trimethyl-phenyl)methyl 3-(methylsulfinylmethyl)benzoate CAS Name: 3-(methylsulfinylmethyl)benzoic acid (3-acetyl-2,4,6-trimethylphenyl)methyl ester IUPAC Name: (3-acetyl-2,4,6-trimethylphenyl)methyl 3-(methylsulfinylmethyl)benzoate Traditional Name: 3-(methylsulfinylmethyl)benzoic acid (3-acetyl-2,4,6-trimethyl-benzyl) ester Formula: C21H24O4S MolecularWeight: 372.47786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(=O)C)C)COC(=O)C2=CC(=CC=C2)CS(=O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C(=O)C)C)COC(=O)C2=CC(=CC=C2)CS(=O)C)C

InChI

InChI=1S/C21H24O4S/c1-13-9-14(2)20(16(4)22)15(3)19(13)11-25-21(23)18-8-6-7-17(10-18)12-26(5)24/h6-10H,11-12H2,1-5H3