(2E)-2-(1,2-dihydroindazol-3-ylidene)-N-[(4-nitrophenyl)methyl]benzimidazole-5-carboxamide

Systemtic Name: (2E)-2-(1,2-dihydroindazol-3-ylidene)-N-[(4-nitrophenyl)methyl]benzimidazole-5-carboxamide Openeye Name: (2E)-2-(1,2-dihydroindazol-3-ylidene)-N-[(4-nitrophenyl)methyl]benzimidazole-5-carboxamide CAS Name: (2E)-2-(1,2-dihydroindazol-3-ylidene)-N-[(4-nitrophenyl)methyl]-5-benzimidazolecarboxamide IUPAC Name: (2E)-2-(1,2-dihydroindazol-3-ylidene)-N-[(4-nitrophenyl)methyl]benzimidazole-5-carboxamide Traditional Name: (2E)-2-indazolin-3-ylidene-N-(4-nitrobenzyl)benzimidazole-5-carboxamide Formula: C22H16N6O3 MolecularWeight: 412.40084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3N=C4C=CC(=CC4=N3)C(=O)NCC5=CC=C(C=C5)[N+](=O)[O-])NN2

Isomeric SMILES

C1=CC=C2C(=C1)/C(=C\3/N=C4C=CC(=CC4=N3)C(=O)NCC5=CC=C(C=C5)[N+](=O)[O-])/NN2

InChI

InChI=1S/C22H16N6O3/c29-22(23-12-13-5-8-15(9-6-13)28(30)31)14-7-10-18-19(11-14)25-21(24-18)20-16-3-1-2-4-17(16)26-27-20/h1-11,26-27H,12H2,(H,23,29)/b21-20+