7-chloranyl-N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: 7-chloranyl-N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: 7-chloro-N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: 7-chloro-N-[4-[3-(4-morpholin-4-iumyl)propylsulfamoyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: 7-chloro-N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: 7-chloro-N-[4-(3-morpholin-4-ium-4-ylpropylsulfamoyl)phenyl]-piperonylamide Formula: C21H25ClN3O6S+ MolecularWeight: 482.9577

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC4=C(C(=C3)Cl)OCO4

Isomeric SMILES

C1COCC[NH+]1CCCNS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC4=C(C(=C3)Cl)OCO4

InChI

InChI=1S/C21H24ClN3O6S/c22-18-12-15(13-19-20(18)31-14-30-19)21(26)24-16-2-4-17(5-3-16)32(27,28)23-6-1-7-25-8-10-29-11-9-25/h2-5,12-13,23H,1,6-11,14H2,(H,24,26)/p+1