N-[3,5-bis(trifluoromethyl)phenyl]-1-(4-nitrophenyl)-5-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-1-(4-nitrophenyl)-5-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-1-(4-nitrophenyl)-5-phenyl-triazole-4-carboxamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-1-(4-nitrophenyl)-5-phenyl-4-triazolecarboxamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-1-(4-nitrophenyl)-5-phenyltriazole-4-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-1-(4-nitrophenyl)-5-phenyl-triazole-4-carboxamide Formula: C23H13F6N5O3 MolecularWeight: 521.371439

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=NN2C3=CC=C(C=C3)[N+](=O)[O-])C(=O)NC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=NN2C3=CC=C(C=C3)[N+](=O)[O-])C(=O)NC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C23H13F6N5O3/c24-22(25,26)14-10-15(23(27,28)29)12-16(11-14)30-21(35)19-20(13-4-2-1-3-5-13)33(32-31-19)17-6-8-18(9-7-17)34(36)37/h1-12H,(H,30,35)