4-(3-azanyl-1H-isoindol-2-ium-2-yl)-N-(3,4-dimethyl-1,2-oxazol-5-yl)benzenesulfonamide

Systemtic Name: 4-(3-azanyl-1H-isoindol-2-ium-2-yl)-N-(3,4-dimethyl-1,2-oxazol-5-yl)benzenesulfonamide Openeye Name: 4-(3-amino-1H-isoindol-2-ium-2-yl)-N-(3,4-dimethylisoxazol-5-yl)benzenesulfonamide CAS Name: 4-(3-amino-1H-isoindol-2-ium-2-yl)-N-(3,4-dimethyl-5-isoxazolyl)benzenesulfonamide IUPAC Name: 4-(3-amino-1H-isoindol-2-ium-2-yl)-N-(3,4-dimethyl-1,2-oxazol-5-yl)benzenesulfonamide Traditional Name: 4-(3-amino-1H-isoindol-2-ium-2-yl)-N-(3,4-dimethylisoxazol-5-yl)benzenesulfonamide Formula: C19H19N4O3S+ MolecularWeight: 383.44416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)[N+]3=C(C4=CC=CC=C4C3)N

Isomeric SMILES

CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)[N+]3=C(C4=CC=CC=C4C3)N

InChI

InChI=1S/C19H18N4O3S/c1-12-13(2)21-26-19(12)22-27(24,25)16-9-7-15(8-10-16)23-11-14-5-3-4-6-17(14)18(23)20/h3-10,20H,11H2,1-2H3,(H,21,22)/p+1