4-chloranyl-2-(furan-2-ylmethylamino)-5-(piperidin-1-ylsulfamoyl)benzoic acid

Systemtic Name: 4-chloranyl-2-(furan-2-ylmethylamino)-5-(piperidin-1-ylsulfamoyl)benzoic acid Openeye Name: 4-chloro-2-(2-furylmethylamino)-5-(1-piperidylsulfamoyl)benzoic acid CAS Name: 4-chloro-2-(2-furanylmethylamino)-5-(1-piperidinylsulfamoyl)benzoic acid IUPAC Name: 4-chloro-2-(furan-2-ylmethylamino)-5-(piperidin-1-ylsulfamoyl)benzoic acid Traditional Name: 4-chloro-2-(2-furfurylamino)-5-(piperidinosulfamoyl)benzoic acid Formula: C17H20ClN3O5S MolecularWeight: 413.8758

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)NS(=O)(=O)C2=C(C=C(C(=C2)C(=O)O)NCC3=CC=CO3)Cl

Isomeric SMILES

C1CCN(CC1)NS(=O)(=O)C2=C(C=C(C(=C2)C(=O)O)NCC3=CC=CO3)Cl

InChI

InChI=1S/C17H20ClN3O5S/c18-14-10-15(19-11-12-5-4-8-26-12)13(17(22)23)9-16(14)27(24,25)20-21-6-2-1-3-7-21/h4-5,8-10,19-20H,1-3,6-7,11H2,(H,22,23)