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

Systemtic Name: 5-[(2-nitrophenyl)methyl]-1H-1,2,4-triazole Openeye Name: 5-[(2-nitrophenyl)methyl]-1H-1,2,4-triazole CAS Name: 5-[(2-nitrophenyl)methyl]-1H-1,2,4-triazole IUPAC Name: 5-[(2-nitrophenyl)methyl]-1H-1,2,4-triazole Traditional Name: 5-(2-nitrobenzyl)-1H-1,2,4-triazole Formula: C9H8N4O2 MolecularWeight: 204.18542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC2=NC=NN2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)CC2=NC=NN2)[N+](=O)[O-]

InChI

InChI=1S/C9H8N4O2/c14-13(15)8-4-2-1-3-7(8)5-9-10-6-11-12-9/h1-4,6H,5H2,(H,10,11,12)