2-azanyl-2-(phenylsulfonyl)isoindol-2-ium-1,3-dione

Systemtic Name: 2-azanyl-2-(phenylsulfonyl)isoindol-2-ium-1,3-dione Openeye Name: 2-amino-2-(benzenesulfonyl)isoindolin-2-ium-1,3-dione CAS Name: 2-amino-2-(benzenesulfonyl)isoindol-2-ium-1,3-dione IUPAC Name: 2-amino-2-(benzenesulfonyl)isoindol-2-ium-1,3-dione Traditional Name: 2-amino-2-besyl-isoindolin-2-ium-1,3-quinone Formula: C14H11N2O4S+ MolecularWeight: 303.31314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)[N+]2(C(=O)C3=CC=CC=C3C2=O)N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)[N+]2(C(=O)C3=CC=CC=C3C2=O)N

InChI

InChI=1S/C14H11N2O4S/c15-16(21(19,20)10-6-2-1-3-7-10)13(17)11-8-4-5-9-12(11)14(16)18/h1-9H,15H2/q+1