3-(5-chloranyl-2-nitro-phenyl)-5-phenyl-2H-1,2,3-triazol-4-one

Systemtic Name: 3-(5-chloranyl-2-nitro-phenyl)-5-phenyl-2H-1,2,3-triazol-4-one Openeye Name: 3-(5-chloro-2-nitro-phenyl)-5-phenyl-2H-triazol-4-one CAS Name: 3-(5-chloro-2-nitrophenyl)-5-phenyl-2H-triazol-4-one IUPAC Name: 3-(5-chloro-2-nitrophenyl)-5-phenyl-2H-triazol-4-one Traditional Name: 3-(5-chloro-2-nitro-phenyl)-5-phenyl-2H-triazol-4-one Formula: C14H9ClN4O3 MolecularWeight: 316.69926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNN(C2=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NNN(C2=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H9ClN4O3/c15-10-6-7-11(19(21)22)12(8-10)18-14(20)13(16-17-18)9-4-2-1-3-5-9/h1-8,17H