1-[5-methyl-2-(3-nitrophenyl)-1,2,3-triazol-4-yl]ethanone

Systemtic Name: 1-[5-methyl-2-(3-nitrophenyl)-1,2,3-triazol-4-yl]ethanone Openeye Name: 1-[5-methyl-2-(3-nitrophenyl)triazol-4-yl]ethanone CAS Name: 1-[5-methyl-2-(3-nitrophenyl)-4-triazolyl]ethanone IUPAC Name: 1-[5-methyl-2-(3-nitrophenyl)triazol-4-yl]ethanone Traditional Name: 1-[5-methyl-2-(3-nitrophenyl)triazol-4-yl]ethanone Formula: C11H10N4O3 MolecularWeight: 246.2221

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)C)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(N=C1C(=O)C)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H10N4O3/c1-7-11(8(2)16)13-14(12-7)9-4-3-5-10(6-9)15(17)18/h3-6H,1-2H3