propanoyloxymethyl 4-chloranyl-2-(furan-2-ylmethylamino)-5-sulfamoyl-benzoate

Systemtic Name: propanoyloxymethyl 4-chloranyl-2-(furan-2-ylmethylamino)-5-sulfamoyl-benzoate Openeye Name: propanoyloxymethyl 4-chloro-2-(2-furylmethylamino)-5-sulfamoyl-benzoate CAS Name: 4-chloro-2-(2-furanylmethylamino)-5-sulfamoylbenzoic acid 1-oxopropoxymethyl ester IUPAC Name: propanoyloxymethyl 4-chloro-2-(furan-2-ylmethylamino)-5-sulfamoylbenzoate Traditional Name: 4-chloro-2-(2-furfurylamino)-5-sulfamoyl-benzoic acid propionyloxymethyl ester Formula: C16H17ClN2O7S MolecularWeight: 416.83338

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCOC(=O)C1=CC(=C(C=C1NCC2=CC=CO2)Cl)S(=O)(=O)N

Isomeric SMILES

CCC(=O)OCOC(=O)C1=CC(=C(C=C1NCC2=CC=CO2)Cl)S(=O)(=O)N

InChI

InChI=1S/C16H17ClN2O7S/c1-2-15(20)25-9-26-16(21)11-6-14(27(18,22)23)12(17)7-13(11)19-8-10-4-3-5-24-10/h3-7,19H,2,8-9H2,1H3,(H2,18,22,23)