N-[5-nitro-2-(2,4,6-trimethylphenyl)-1,2,3-triazol-4-yl]ethanamide

Systemtic Name: N-[5-nitro-2-(2,4,6-trimethylphenyl)-1,2,3-triazol-4-yl]ethanamide Openeye Name: N-[5-nitro-2-(2,4,6-trimethylphenyl)triazol-4-yl]acetamide CAS Name: N-[5-nitro-2-(2,4,6-trimethylphenyl)-4-triazolyl]acetamide IUPAC Name: N-[5-nitro-2-(2,4,6-trimethylphenyl)triazol-4-yl]acetamide Traditional Name: N-(2-mesityl-5-nitro-triazol-4-yl)acetamide Formula: C13H15N5O3 MolecularWeight: 289.2899

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N2N=C(C(=N2)[N+](=O)[O-])NC(=O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N2N=C(C(=N2)[N+](=O)[O-])NC(=O)C)C

InChI

InChI=1S/C13H15N5O3/c1-7-5-8(2)11(9(3)6-7)17-15-12(14-10(4)19)13(16-17)18(20)21/h5-6H,1-4H3,(H,14,15,19)