diethyl 2-[2-bromanyl-1-phenyl-2-(phenylsulfonyl)ethylidene]propanedioate

Systemtic Name: diethyl 2-[2-bromanyl-1-phenyl-2-(phenylsulfonyl)ethylidene]propanedioate Openeye Name: diethyl 2-[2-(benzenesulfonyl)-2-bromo-1-phenyl-ethylidene]propanedioate CAS Name: 2-[2-(benzenesulfonyl)-2-bromo-1-phenylethylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[2-(benzenesulfonyl)-2-bromo-1-phenylethylidene]propanedioate Traditional Name: 2-(2-besyl-2-bromo-1-phenyl-ethylidene)malonic acid diethyl ester Formula: C21H21BrO6S MolecularWeight: 481.35684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C1=CC=CC=C1)C(S(=O)(=O)C2=CC=CC=C2)Br)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=C(C1=CC=CC=C1)C(S(=O)(=O)C2=CC=CC=C2)Br)C(=O)OCC

InChI

InChI=1S/C21H21BrO6S/c1-3-27-20(23)18(21(24)28-4-2)17(15-11-7-5-8-12-15)19(22)29(25,26)16-13-9-6-10-14-16/h5-14,19H,3-4H2,1-2H3