1-[2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-oxo-2-(3-sulfamoylanilino)ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[2-oxo-2-(3-sulfamoylanilino)ethyl]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-oxo-2-(3-sulfamoylanilino)ethyl]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[2-keto-2-(3-sulfamoylanilino)ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C20H25N4O4S+ MolecularWeight: 417.5019

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N

InChI

InChI=1S/C20H24N4O4S/c21-29(27,28)18-8-4-7-17(13-18)22-19(25)14-24-11-9-15(10-12-24)20(26)23-16-5-2-1-3-6-16/h1-8,13,15H,9-12,14H2,(H,22,25)(H,23,26)(H2,21,27,28)/p+1