N-[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]-1-oxidanidyl-pyridin-1-ium-2-carboxamide

Systemtic Name: N-[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]-1-oxidanidyl-pyridin-1-ium-2-carboxamide Openeye Name: N-[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]-1-oxido-pyridin-1-ium-2-carboxamide CAS Name: N-[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]-1-oxido-2-pyridin-1-iumcarboxamide IUPAC Name: N-[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]-1-oxidopyridin-1-ium-2-carboxamide Traditional Name: N-[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]-1-oxido-pyridin-1-ium-2-carboxamide Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=[N+]3[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=[N+]3[O-])C

InChI

InChI=1S/C20H19N3O4S/c1-14-6-7-17(13-15(14)2)22-28(26,27)18-10-8-16(9-11-18)21-20(24)19-5-3-4-12-23(19)25/h3-13,22H,1-2H3,(H,21,24)