2-(3-nitro-1,2,4-triazol-1-yl)-N-[(E)-phenethylideneamino]ethanamide

Systemtic Name: 2-(3-nitro-1,2,4-triazol-1-yl)-N-[(E)-phenethylideneamino]ethanamide Openeye Name: 2-(3-nitro-1,2,4-triazol-1-yl)-N-[(E)-phenethylideneamino]acetamide CAS Name: 2-(3-nitro-1,2,4-triazol-1-yl)-N-[(E)-phenethylideneamino]acetamide IUPAC Name: 2-(3-nitro-1,2,4-triazol-1-yl)-N-[(E)-phenethylideneamino]acetamide Traditional Name: 2-(3-nitro-1,2,4-triazol-1-yl)-N-[(E)-phenethylideneamino]acetamide Formula: C12H12N6O3 MolecularWeight: 288.26208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC=NNC(=O)CN2C=NC(=N2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C/C=N/NC(=O)CN2C=NC(=N2)[N+](=O)[O-]

InChI

InChI=1S/C12H12N6O3/c19-11(8-17-9-13-12(16-17)18(20)21)15-14-7-6-10-4-2-1-3-5-10/h1-5,7,9H,6,8H2,(H,15,19)/b14-7+