[2-[2,4-di(propan-2-yl)phenyl]-2-oxidanylidene-ethyl] 4-(methylsulfonylmethyl)benzoate

Systemtic Name: [2-[2,4-di(propan-2-yl)phenyl]-2-oxidanylidene-ethyl] 4-(methylsulfonylmethyl)benzoate Openeye Name: [2-(2,4-diisopropylphenyl)-2-oxo-ethyl] 4-(methylsulfonylmethyl)benzoate CAS Name: 4-(methylsulfonylmethyl)benzoic acid [2-[2,4-di(propan-2-yl)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[2,4-di(propan-2-yl)phenyl]-2-oxoethyl] 4-(methylsulfonylmethyl)benzoate Traditional Name: 4-(mesylmethyl)benzoic acid [2-(2,4-diisopropylphenyl)-2-keto-ethyl] ester Formula: C23H28O5S MolecularWeight: 416.53042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)CS(=O)(=O)C)C(C)C

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)CS(=O)(=O)C)C(C)C

InChI

InChI=1S/C23H28O5S/c1-15(2)19-10-11-20(21(12-19)16(3)4)22(24)13-28-23(25)18-8-6-17(7-9-18)14-29(5,26)27/h6-12,15-16H,13-14H2,1-5H3