2-(6,12-dihydro-5H-benzimidazolo[1,2-c]quinazolin-7-ium-6-yl)-4-nitro-phenolate

Systemtic Name: 2-(6,12-dihydro-5H-benzimidazolo[1,2-c]quinazolin-7-ium-6-yl)-4-nitro-phenolate Openeye Name: 2-(6,12-dihydro-5H-benzimidazolo[1,2-c]quinazolin-7-ium-6-yl)-4-nitro-phenolate CAS Name: 2-(6,12-dihydro-5H-benzimidazolo[1,2-c]quinazolin-7-ium-6-yl)-4-nitrophenolate IUPAC Name: 2-(6,12-dihydro-5H-benzimidazolo[1,2-c]quinazolin-7-ium-6-yl)-4-nitrophenolate Traditional Name: 2-(6,12-dihydro-5H-benzimidazolo[1,2-c]quinazolin-7-ium-6-yl)-4-nitro-phenolate Formula: C20H14N4O3 MolecularWeight: 358.35016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=[N+](C(N2)C4=C(C=CC(=C4)[N+](=O)[O-])[O-])C5=CC=CC=C5N3

Isomeric SMILES

C1=CC=C2C(=C1)C3=[N+](C(N2)C4=C(C=CC(=C4)[N+](=O)[O-])[O-])C5=CC=CC=C5N3

InChI

InChI=1S/C20H14N4O3/c25-18-10-9-12(24(26)27)11-14(18)20-21-15-6-2-1-5-13(15)19-22-16-7-3-4-8-17(16)23(19)20/h1-11,20H,(H2,21,22,25)