methyl 3-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoyloxymethyl]benzoate

Systemtic Name: methyl 3-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoyloxymethyl]benzoate Openeye Name: methyl 3-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoyloxymethyl]benzoate CAS Name: 3-[[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-oxopropoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoyloxymethyl]benzoate Traditional Name: 3-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanoyloxymethyl]benzoic acid methyl ester Formula: C20H20O8S MolecularWeight: 420.433

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)COC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)COC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H20O8S/c1-25-20(22)15-4-2-3-14(11-15)13-28-19(21)7-10-29(23,24)16-5-6-17-18(12-16)27-9-8-26-17/h2-6,11-12H,7-10,13H2,1H3