3-nitro-1-prop-2-ynyl-1,2,4-triazole

Systemtic Name: 3-nitro-1-prop-2-ynyl-1,2,4-triazole Openeye Name: 3-nitro-1-prop-2-ynyl-1,2,4-triazole CAS Name: 3-nitro-1-prop-2-ynyl-1,2,4-triazole IUPAC Name: 3-nitro-1-prop-2-ynyl-1,2,4-triazole Traditional Name: 3-nitro-1-propargyl-1,2,4-triazole Formula: C5H4N4O2 MolecularWeight: 152.11086

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C=NC(=N1)[N+](=O)[O-]

Isomeric SMILES

C#CCN1C=NC(=N1)[N+](=O)[O-]

InChI

InChI=1S/C5H4N4O2/c1-2-3-8-4-6-5(7-8)9(10)11/h1,4H,3H2