3-(4-nitrophenyl)-5-(phenoxymethyl)-1H-1,2,4-triazole

Systemtic Name: 3-(4-nitrophenyl)-5-(phenoxymethyl)-1H-1,2,4-triazole Openeye Name: 3-(4-nitrophenyl)-5-(phenoxymethyl)-1H-1,2,4-triazole CAS Name: 3-(4-nitrophenyl)-5-(phenoxymethyl)-1H-1,2,4-triazole IUPAC Name: 3-(4-nitrophenyl)-5-(phenoxymethyl)-1H-1,2,4-triazole Traditional Name: 3-(4-nitrophenyl)-5-(phenoxymethyl)-1H-1,2,4-triazole Formula: C15H12N4O3 MolecularWeight: 296.28078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=NC(=NN2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCC2=NC(=NN2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H12N4O3/c20-19(21)12-8-6-11(7-9-12)15-16-14(17-18-15)10-22-13-4-2-1-3-5-13/h1-9H,10H2,(H,16,17,18)