5-(2-nitrophenyl)-1H-1,2,4-triazole-3-carbonitrile

Systemtic Name: 5-(2-nitrophenyl)-1H-1,2,4-triazole-3-carbonitrile Openeye Name: 5-(2-nitrophenyl)-1H-1,2,4-triazole-3-carbonitrile CAS Name: 5-(2-nitrophenyl)-1H-1,2,4-triazole-3-carbonitrile IUPAC Name: 5-(2-nitrophenyl)-1H-1,2,4-triazole-3-carbonitrile Traditional Name: 5-(2-nitrophenyl)-1H-1,2,4-triazole-3-carbonitrile Formula: C9H5N5O2 MolecularWeight: 215.1683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC(=NN2)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC(=NN2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C9H5N5O2/c10-5-8-11-9(13-12-8)6-3-1-2-4-7(6)14(15)16/h1-4H,(H,11,12,13)