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

Systemtic Name: 5-[(4-chloranylphenoxy)methyl]-3-(2-nitrophenyl)-1H-1,2,4-triazole Openeye Name: 5-[(4-chlorophenoxy)methyl]-3-(2-nitrophenyl)-1H-1,2,4-triazole CAS Name: 5-[(4-chlorophenoxy)methyl]-3-(2-nitrophenyl)-1H-1,2,4-triazole IUPAC Name: 5-[(4-chlorophenoxy)methyl]-3-(2-nitrophenyl)-1H-1,2,4-triazole Traditional Name: 5-[(4-chlorophenoxy)methyl]-3-(2-nitrophenyl)-1H-1,2,4-triazole Formula: C15H11ClN4O3 MolecularWeight: 330.72584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NNC(=N2)COC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=NNC(=N2)COC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H11ClN4O3/c16-10-5-7-11(8-6-10)23-9-14-17-15(19-18-14)12-3-1-2-4-13(12)20(21)22/h1-8H,9H2,(H,17,18,19)