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

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-1-[2-(trifluoromethyl)phenyl]-1,2,3-triazole-4-carboxamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxamide CAS Name: N-(2-methoxy-5-nitrophenyl)-1-[2-(trifluoromethyl)phenyl]-4-triazolecarboxamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxamide Formula: C17H12F3N5O4 MolecularWeight: 407.30349

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=CN(N=N2)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=CN(N=N2)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C17H12F3N5O4/c1-29-15-7-6-10(25(27)28)8-12(15)21-16(26)13-9-24(23-22-13)14-5-3-2-4-11(14)17(18,19)20/h2-9H,1H3,(H,21,26)