3-ethyl-5-[(2-nitrophenyl)methyl]-1H-1,2,4-triazole

Systemtic Name: 3-ethyl-5-[(2-nitrophenyl)methyl]-1H-1,2,4-triazole Openeye Name: 3-ethyl-5-[(2-nitrophenyl)methyl]-1H-1,2,4-triazole CAS Name: 3-ethyl-5-[(2-nitrophenyl)methyl]-1H-1,2,4-triazole IUPAC Name: 3-ethyl-5-[(2-nitrophenyl)methyl]-1H-1,2,4-triazole Traditional Name: 3-ethyl-5-(2-nitrobenzyl)-1H-1,2,4-triazole Formula: C11H12N4O2 MolecularWeight: 232.23858

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=N1)CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCC1=NNC(=N1)CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C11H12N4O2/c1-2-10-12-11(14-13-10)7-8-5-3-4-6-9(8)15(16)17/h3-6H,2,7H2,1H3,(H,12,13,14)