3-nitro-1-[2-(4-nitrophenyl)ethyl]-1,2,4-triazole

Systemtic Name: 3-nitro-1-[2-(4-nitrophenyl)ethyl]-1,2,4-triazole Openeye Name: 3-nitro-1-[2-(4-nitrophenyl)ethyl]-1,2,4-triazole CAS Name: 3-nitro-1-[2-(4-nitrophenyl)ethyl]-1,2,4-triazole IUPAC Name: 3-nitro-1-[2-(4-nitrophenyl)ethyl]-1,2,4-triazole Traditional Name: 3-nitro-1-[2-(4-nitrophenyl)ethyl]-1,2,4-triazole Formula: C10H9N5O4 MolecularWeight: 263.20956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCN2C=NC(=N2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CCN2C=NC(=N2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C10H9N5O4/c16-14(17)9-3-1-8(2-4-9)5-6-13-7-11-10(12-13)15(18)19/h1-4,7H,5-6H2