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

Systemtic Name: 5-[1-(4-chloranyl-2-methyl-phenoxy)ethyl]-3-(4-nitrophenyl)-1H-1,2,4-triazole Openeye Name: 5-[1-(4-chloro-2-methyl-phenoxy)ethyl]-3-(4-nitrophenyl)-1H-1,2,4-triazole CAS Name: 5-[1-(4-chloro-2-methylphenoxy)ethyl]-3-(4-nitrophenyl)-1H-1,2,4-triazole IUPAC Name: 5-[1-(4-chloro-2-methylphenoxy)ethyl]-3-(4-nitrophenyl)-1H-1,2,4-triazole Traditional Name: 5-[1-(4-chloro-2-methyl-phenoxy)ethyl]-3-(4-nitrophenyl)-1H-1,2,4-triazole Formula: C17H15ClN4O3 MolecularWeight: 358.779

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OC(C)C2=NC(=NN2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OC(C)C2=NC(=NN2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15ClN4O3/c1-10-9-13(18)5-8-15(10)25-11(2)16-19-17(21-20-16)12-3-6-14(7-4-12)22(23)24/h3-9,11H,1-2H3,(H,19,20,21)