5-(butoxymethylsulfamoyl)-4-chloranyl-2-(furan-2-ylmethylamino)benzoic acid

Systemtic Name: 5-(butoxymethylsulfamoyl)-4-chloranyl-2-(furan-2-ylmethylamino)benzoic acid Openeye Name: 5-(butoxymethylsulfamoyl)-4-chloro-2-(2-furylmethylamino)benzoic acid CAS Name: 5-(butoxymethylsulfamoyl)-4-chloro-2-(2-furanylmethylamino)benzoic acid IUPAC Name: 5-(butoxymethylsulfamoyl)-4-chloro-2-(furan-2-ylmethylamino)benzoic acid Traditional Name: 5-(butoxymethylsulfamoyl)-4-chloro-2-(2-furfurylamino)benzoic acid Formula: C17H21ClN2O6S MolecularWeight: 416.87644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCNS(=O)(=O)C1=C(C=C(C(=C1)C(=O)O)NCC2=CC=CO2)Cl

Isomeric SMILES

CCCCOCNS(=O)(=O)C1=C(C=C(C(=C1)C(=O)O)NCC2=CC=CO2)Cl

InChI

InChI=1S/C17H21ClN2O6S/c1-2-3-6-25-11-20-27(23,24)16-8-13(17(21)22)15(9-14(16)18)19-10-12-5-4-7-26-12/h4-5,7-9,19-20H,2-3,6,10-11H2,1H3,(H,21,22)