[2-oxidanylidene-2-(4-propylphenyl)ethyl] 3-methylsulfonylbenzoate

Systemtic Name: [2-oxidanylidene-2-(4-propylphenyl)ethyl] 3-methylsulfonylbenzoate Openeye Name: [2-oxo-2-(4-propylphenyl)ethyl] 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid [2-oxo-2-(4-propylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-propylphenyl)ethyl] 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid [2-keto-2-(4-propylphenyl)ethyl] ester Formula: C19H20O5S MolecularWeight: 360.4241

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C19H20O5S/c1-3-5-14-8-10-15(11-9-14)18(20)13-24-19(21)16-6-4-7-17(12-16)25(2,22)23/h4,6-12H,3,5,13H2,1-2H3