2-[4-(phenylcarbonyl)pyridin-1-ium-1-yl]-N-(3-sulfamoylphenyl)ethanamide

Systemtic Name: 2-[4-(phenylcarbonyl)pyridin-1-ium-1-yl]-N-(3-sulfamoylphenyl)ethanamide Openeye Name: 2-(4-benzoylpyridin-1-ium-1-yl)-N-(3-sulfamoylphenyl)acetamide CAS Name: 2-(4-benzoyl-1-pyridin-1-iumyl)-N-(3-sulfamoylphenyl)acetamide IUPAC Name: 2-(4-benzoylpyridin-1-ium-1-yl)-N-(3-sulfamoylphenyl)acetamide Traditional Name: 2-(4-benzoylpyridin-1-ium-1-yl)-N-(3-sulfamoylphenyl)acetamide Formula: C20H18N3O4S+ MolecularWeight: 396.43962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=[N+](C=C2)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=[N+](C=C2)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N

InChI

InChI=1S/C20H17N3O4S/c21-28(26,27)18-8-4-7-17(13-18)22-19(24)14-23-11-9-16(10-12-23)20(25)15-5-2-1-3-6-15/h1-13H,14H2,(H2-,21,22,24,26,27)/p+1