3-(4-nitrophenyl)-4-oxidanylidene-imidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamide

Systemtic Name: 3-(4-nitrophenyl)-4-oxidanylidene-imidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamide Openeye Name: 3-(4-nitrophenyl)-4-oxo-imidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamide CAS Name: 3-(4-nitrophenyl)-4-oxo-8-imidazo[5,1-d][1,2,3,5]tetrazinecarboxamide IUPAC Name: 3-(4-nitrophenyl)-4-oxoimidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamide Traditional Name: 4-keto-3-(4-nitrophenyl)imidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamide Formula: C11H7N7O4 MolecularWeight: 301.21778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)N3C=NC(=C3N=N2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)N3C=NC(=C3N=N2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C11H7N7O4/c12-9(19)8-10-14-15-17(11(20)16(10)5-13-8)6-1-3-7(4-2-6)18(21)22/h1-5H,(H2,12,19)