4-chloranyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-3-[(phenylmethyl)sulfamoyl]benzamide

Systemtic Name: 4-chloranyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-3-[(phenylmethyl)sulfamoyl]benzamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-(benzylsulfamoyl)-4-chloro-benzamide CAS Name: 4-chloro-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-3-[(phenylmethyl)sulfamoyl]benzamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-(benzylsulfamoyl)-4-chlorobenzamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-(benzylsulfamoyl)-4-chloro-benzamide Formula: C26H29ClN3O3S+ MolecularWeight: 499.04476

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NCC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NCC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C26H28ClN3O3S/c27-24-12-11-22(17-25(24)34(32,33)28-18-20-7-3-1-4-8-20)26(31)29-23-13-15-30(16-14-23)19-21-9-5-2-6-10-21/h1-12,17,23,28H,13-16,18-19H2,(H,29,31)/p+1