diethyl 2-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]sulfonylamino]propanedioate

Systemtic Name: diethyl 2-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]sulfonylamino]propanedioate Openeye Name: diethyl 2-[(3,5-dichloro-2-hydroxy-phenyl)sulfonylamino]propanedioate CAS Name: 2-[(3,5-dichloro-2-hydroxyphenyl)sulfonylamino]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(3,5-dichloro-2-hydroxyphenyl)sulfonylamino]propanedioate Traditional Name: 2-[(3,5-dichloro-2-hydroxy-phenyl)sulfonylamino]malonic acid diethyl ester Formula: C13H15Cl2NO7S MolecularWeight: 400.2317

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)NS(=O)(=O)C1=CC(=CC(=C1O)Cl)Cl

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)NS(=O)(=O)C1=CC(=CC(=C1O)Cl)Cl

InChI

InChI=1S/C13H15Cl2NO7S/c1-3-22-12(18)10(13(19)23-4-2)16-24(20,21)9-6-7(14)5-8(15)11(9)17/h5-6,10,16-17H,3-4H2,1-2H3