2-(1,3-benzothiazol-2-yl)-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-4-nitro-isoindole-1,3-dione Openeye Name: 2-(1,3-benzothiazol-2-yl)-4-nitro-isoindoline-1,3-dione CAS Name: 2-(1,3-benzothiazol-2-yl)-4-nitroisoindole-1,3-dione IUPAC Name: 2-(1,3-benzothiazol-2-yl)-4-nitroisoindole-1,3-dione Traditional Name: 2-(1,3-benzothiazol-2-yl)-4-nitro-isoindoline-1,3-quinone Formula: C15H7N3O4S MolecularWeight: 325.29878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)N3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)N3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C15H7N3O4S/c19-13-8-4-3-6-10(18(21)22)12(8)14(20)17(13)15-16-9-5-1-2-7-11(9)23-15/h1-7H