2-(1H-benzimidazol-2-yl)-2-nitro-indene-1,3-dione

Systemtic Name: 2-(1H-benzimidazol-2-yl)-2-nitro-indene-1,3-dione Openeye Name: 2-(1H-benzimidazol-2-yl)-2-nitro-indane-1,3-dione CAS Name: 2-(1H-benzimidazol-2-yl)-2-nitroindene-1,3-dione IUPAC Name: 2-(1H-benzimidazol-2-yl)-2-nitroindene-1,3-dione Traditional Name: 2-(1H-benzimidazol-2-yl)-2-nitro-indane-1,3-quinone Formula: C16H9N3O4 MolecularWeight: 307.26036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(C2=O)(C3=NC4=CC=CC=C4N3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(C2=O)(C3=NC4=CC=CC=C4N3)[N+](=O)[O-]

InChI

InChI=1S/C16H9N3O4/c20-13-9-5-1-2-6-10(9)14(21)16(13,19(22)23)15-17-11-7-3-4-8-12(11)18-15/h1-8H,(H,17,18)