3-(3-chlorophenyl)-5-(3-methyl-4-nitro-phenyl)-1H-1,2,4-triazole

Systemtic Name: 3-(3-chlorophenyl)-5-(3-methyl-4-nitro-phenyl)-1H-1,2,4-triazole Openeye Name: 3-(3-chlorophenyl)-5-(3-methyl-4-nitro-phenyl)-1H-1,2,4-triazole CAS Name: 3-(3-chlorophenyl)-5-(3-methyl-4-nitrophenyl)-1H-1,2,4-triazole IUPAC Name: 3-(3-chlorophenyl)-5-(3-methyl-4-nitrophenyl)-1H-1,2,4-triazole Traditional Name: 3-(3-chlorophenyl)-5-(3-methyl-4-nitro-phenyl)-1H-1,2,4-triazole Formula: C15H11ClN4O2 MolecularWeight: 314.72644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11ClN4O2/c1-9-7-11(5-6-13(9)20(21)22)15-17-14(18-19-15)10-3-2-4-12(16)8-10/h2-8H,1H3,(H,17,18,19)