diethyl 2-[chloranyl-bis(phenylsulfonyl)methyl]sulfanylpropanedioate

Systemtic Name: diethyl 2-[chloranyl-bis(phenylsulfonyl)methyl]sulfanylpropanedioate Openeye Name: diethyl 2-[bis(benzenesulfonyl)-chloro-methyl]sulfanylpropanedioate CAS Name: 2-[[bis(benzenesulfonyl)-chloromethyl]thio]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[bis(benzenesulfonyl)-chloromethyl]sulfanylpropanedioate Traditional Name: 2-[[dibesyl(chloro)methyl]thio]malonic acid diethyl ester Formula: C20H21ClO8S3 MolecularWeight: 521.02394

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)SC(S(=O)(=O)C1=CC=CC=C1)(S(=O)(=O)C2=CC=CC=C2)Cl

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)SC(S(=O)(=O)C1=CC=CC=C1)(S(=O)(=O)C2=CC=CC=C2)Cl

InChI

InChI=1S/C20H21ClO8S3/c1-3-28-18(22)17(19(23)29-4-2)30-20(21,31(24,25)15-11-7-5-8-12-15)32(26,27)16-13-9-6-10-14-16/h5-14,17H,3-4H2,1-2H3