2-(1,3-benzothiazol-2-yl)-5-nitro-indene-1,3-dione

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-5-nitro-indene-1,3-dione Openeye Name: 2-(1,3-benzothiazol-2-yl)-5-nitro-indane-1,3-dione CAS Name: 2-(1,3-benzothiazol-2-yl)-5-nitroindene-1,3-dione IUPAC Name: 2-(1,3-benzothiazol-2-yl)-5-nitroindene-1,3-dione Traditional Name: 2-(1,3-benzothiazol-2-yl)-5-nitro-indane-1,3-quinone Formula: C16H8N2O4S MolecularWeight: 324.31072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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