2-isoquinolin-2-ium-2-yl-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide

Systemtic Name: 2-isoquinolin-2-ium-2-yl-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide Openeye Name: 2-isoquinolin-2-ium-2-yl-N-[2-(4-sulfamoylphenyl)ethyl]acetamide CAS Name: 2-(2-isoquinolin-2-iumyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide IUPAC Name: 2-isoquinolin-2-ium-2-yl-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Traditional Name: 2-isoquinolin-2-ium-2-yl-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Formula: C19H20N3O3S+ MolecularWeight: 370.4454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C19H19N3O3S/c20-26(24,25)18-7-5-15(6-8-18)9-11-21-19(23)14-22-12-10-16-3-1-2-4-17(16)13-22/h1-8,10,12-13H,9,11,14H2,(H2-,20,21,23,24,25)/p+1