(5-nitro-1H-imidazol-2-yl)methyl 4-nitrobenzoate

Systemtic Name: (5-nitro-1H-imidazol-2-yl)methyl 4-nitrobenzoate Openeye Name: (5-nitro-1H-imidazol-2-yl)methyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (5-nitro-1H-imidazol-2-yl)methyl ester IUPAC Name: (5-nitro-1H-imidazol-2-yl)methyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (5-nitro-1H-imidazol-2-yl)methyl ester Formula: C11H8N4O6 MolecularWeight: 292.20442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC2=NC=C(N2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC2=NC=C(N2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H8N4O6/c16-11(7-1-3-8(4-2-7)14(17)18)21-6-9-12-5-10(13-9)15(19)20/h1-5H,6H2,(H,12,13)