N-[3-(3-methylphenoxy)-5-nitro-phenyl]-2-(3-nitro-1,2,4-triazol-1-yl)ethanamide

Systemtic Name: N-[3-(3-methylphenoxy)-5-nitro-phenyl]-2-(3-nitro-1,2,4-triazol-1-yl)ethanamide Openeye Name: N-[3-(3-methylphenoxy)-5-nitro-phenyl]-2-(3-nitro-1,2,4-triazol-1-yl)acetamide CAS Name: N-[3-(3-methylphenoxy)-5-nitrophenyl]-2-(3-nitro-1,2,4-triazol-1-yl)acetamide IUPAC Name: N-[3-(3-methylphenoxy)-5-nitrophenyl]-2-(3-nitro-1,2,4-triazol-1-yl)acetamide Traditional Name: N-[3-(3-methylphenoxy)-5-nitro-phenyl]-2-(3-nitro-1,2,4-triazol-1-yl)acetamide Formula: C17H14N6O6 MolecularWeight: 398.32966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CN3C=NC(=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CN3C=NC(=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N6O6/c1-11-3-2-4-14(5-11)29-15-7-12(6-13(8-15)22(25)26)19-16(24)9-21-10-18-17(20-21)23(27)28/h2-8,10H,9H2,1H3,(H,19,24)