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

Systemtic Name: N-[4-[2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)ethanoyl]phenyl]ethanamide Openeye Name: N-[4-[2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)acetyl]phenyl]acetamide CAS Name: N-[4-[2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)-1-oxoethyl]phenyl]acetamide IUPAC Name: N-[4-[2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)acetyl]phenyl]acetamide Traditional Name: N-[4-[2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)acetyl]phenyl]acetamide Formula: C13H13N5O4 MolecularWeight: 303.27342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1CC(=O)C2=CC=C(C=C2)NC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=NN1CC(=O)C2=CC=C(C=C2)NC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C13H13N5O4/c1-8-14-13(18(21)22)16-17(8)7-12(20)10-3-5-11(6-4-10)15-9(2)19/h3-6H,7H2,1-2H3,(H,15,19)