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

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-4-nitro-indene-1,3-dione Openeye Name: 2-(1,3-benzothiazol-2-yl)-4-nitro-indane-1,3-dione CAS Name: 2-(1,3-benzothiazol-2-yl)-4-nitroindene-1,3-dione IUPAC Name: 2-(1,3-benzothiazol-2-yl)-4-nitroindene-1,3-dione Traditional Name: 2-(1,3-benzothiazol-2-yl)-4-nitro-indane-1,3-quinone Formula: C16H8N2O4S MolecularWeight: 324.31072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H8N2O4S/c19-14-8-4-3-6-10(18(21)22)12(8)15(20)13(14)16-17-9-5-1-2-7-11(9)23-16/h1-7,13H