4-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]benzenesulfonamide

Systemtic Name: 4-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]benzenesulfonamide Openeye Name: 4-(5-nitro-1,3-dioxo-isoindolin-2-yl)benzenesulfonamide CAS Name: 4-(5-nitro-1,3-dioxo-2-isoindolyl)benzenesulfonamide IUPAC Name: 4-(5-nitro-1,3-dioxoisoindol-2-yl)benzenesulfonamide Traditional Name: 4-(1,3-diketo-5-nitro-isoindolin-2-yl)benzenesulfonamide Formula: C14H9N3O6S MolecularWeight: 347.30276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N

InChI

InChI=1S/C14H9N3O6S/c15-24(22,23)10-4-1-8(2-5-10)16-13(18)11-6-3-9(17(20)21)7-12(11)14(16)19/h1-7H,(H2,15,22,23)