2-morpholin-4-ylethyl 4-chloranyl-2-(furan-2-ylmethylamino)-5-sulfamoyl-benzoate

Systemtic Name: 2-morpholin-4-ylethyl 4-chloranyl-2-(furan-2-ylmethylamino)-5-sulfamoyl-benzoate Openeye Name: 2-morpholinoethyl 4-chloro-2-(2-furylmethylamino)-5-sulfamoyl-benzoate CAS Name: 4-chloro-2-(2-furanylmethylamino)-5-sulfamoylbenzoic acid 2-(4-morpholinyl)ethyl ester IUPAC Name: 2-morpholin-4-ylethyl 4-chloro-2-(furan-2-ylmethylamino)-5-sulfamoylbenzoate Traditional Name: 4-chloro-2-(2-furfurylamino)-5-sulfamoyl-benzoic acid 2-morpholinoethyl ester Formula: C18H22ClN3O6S MolecularWeight: 443.90178

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCOC(=O)C2=CC(=C(C=C2NCC3=CC=CO3)Cl)S(=O)(=O)N

Isomeric SMILES

C1COCCN1CCOC(=O)C2=CC(=C(C=C2NCC3=CC=CO3)Cl)S(=O)(=O)N

InChI

InChI=1S/C18H22ClN3O6S/c19-15-11-16(21-12-13-2-1-6-27-13)14(10-17(15)29(20,24)25)18(23)28-9-5-22-3-7-26-8-4-22/h1-2,6,10-11,21H,3-5,7-9,12H2,(H2,20,24,25)