diethyl 2-[(4-acetamido-3-chloranyl-phenyl)sulfonylamino]propanedioate

Systemtic Name: diethyl 2-[(4-acetamido-3-chloranyl-phenyl)sulfonylamino]propanedioate Openeye Name: diethyl 2-[(4-acetamido-3-chloro-phenyl)sulfonylamino]propanedioate CAS Name: 2-[(4-acetamido-3-chlorophenyl)sulfonylamino]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(4-acetamido-3-chlorophenyl)sulfonylamino]propanedioate Traditional Name: 2-[(4-acetamido-3-chloro-phenyl)sulfonylamino]malonic acid diethyl ester Formula: C15H19ClN2O7S MolecularWeight: 406.83856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19ClN2O7S/c1-4-24-14(20)13(15(21)25-5-2)18-26(22,23)10-6-7-12(11(16)8-10)17-9(3)19/h6-8,13,18H,4-5H2,1-3H3,(H,17,19)