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

Systemtic Name: [2-[2,4-di(propan-2-yl)phenyl]-2-oxidanylidene-ethyl] 4-methylsulfonylbenzoate Openeye Name: [2-(2,4-diisopropylphenyl)-2-oxo-ethyl] 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic 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-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid [2-(2,4-diisopropylphenyl)-2-keto-ethyl] ester Formula: C22H26O5S MolecularWeight: 402.50384

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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)S(=O)(=O)C)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H26O5S/c1-14(2)17-8-11-19(20(12-17)15(3)4)21(23)13-27-22(24)16-6-9-18(10-7-16)28(5,25)26/h6-12,14-15H,13H2,1-5H3