[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 3-[(4-chlorophenyl)sulfonylamino]propanoate

Systemtic Name: [2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 3-[(4-chlorophenyl)sulfonylamino]propanoate Openeye Name: [2-(2-furylmethylamino)-2-oxo-ethyl] 3-[(4-chlorophenyl)sulfonylamino]propanoate CAS Name: 3-[(4-chlorophenyl)sulfonylamino]propanoic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(furan-2-ylmethylamino)-2-oxoethyl] 3-[(4-chlorophenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-chlorophenyl)sulfonylamino]propionic acid [2-(2-furfurylamino)-2-keto-ethyl] ester Formula: C16H17ClN2O6S MolecularWeight: 400.83398

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=O)COC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

C1=COC(=C1)CNC(=O)COC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H17ClN2O6S/c17-12-3-5-14(6-4-12)26(22,23)19-8-7-16(21)25-11-15(20)18-10-13-2-1-9-24-13/h1-6,9,19H,7-8,10-11H2,(H,18,20)