ethyl 3-[3-(4-methylphenyl)sulfonylpropanoyloxymethyl]benzoate

Systemtic Name: ethyl 3-[3-(4-methylphenyl)sulfonylpropanoyloxymethyl]benzoate Openeye Name: ethyl 3-[3-(p-tolylsulfonyl)propanoyloxymethyl]benzoate CAS Name: 3-[[3-(4-methylphenyl)sulfonyl-1-oxopropoxy]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[3-(4-methylphenyl)sulfonylpropanoyloxymethyl]benzoate Traditional Name: 3-(3-tosylpropanoyloxymethyl)benzoic acid ethyl ester Formula: C20H22O6S MolecularWeight: 390.45008

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)COC(=O)CCS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)COC(=O)CCS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C20H22O6S/c1-3-25-20(22)17-6-4-5-16(13-17)14-26-19(21)11-12-27(23,24)18-9-7-15(2)8-10-18/h4-10,13H,3,11-12,14H2,1-2H3