N-[3-(1,3-benzodioxol-5-ylcarbonylamino)phenyl]-6-(trifluoromethyl)pyridine-3-carboxamide

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylcarbonylamino)phenyl]-6-(trifluoromethyl)pyridine-3-carboxamide Openeye Name: N-[3-(1,3-benzodioxole-5-carbonylamino)phenyl]-6-(trifluoromethyl)pyridine-3-carboxamide CAS Name: N-[3-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]phenyl]-6-(trifluoromethyl)-3-pyridinecarboxamide IUPAC Name: N-[3-(1,3-benzodioxole-5-carbonylamino)phenyl]-6-(trifluoromethyl)pyridine-3-carboxamide Traditional Name: N-[3-(piperonyloylamino)phenyl]-6-(trifluoromethyl)nicotinamide Formula: C21H14F3N3O4 MolecularWeight: 429.34877

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC(=CC=C3)NC(=O)C4=CN=C(C=C4)C(F)(F)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC(=CC=C3)NC(=O)C4=CN=C(C=C4)C(F)(F)F

InChI

InChI=1S/C21H14F3N3O4/c22-21(23,24)18-7-5-13(10-25-18)20(29)27-15-3-1-2-14(9-15)26-19(28)12-4-6-16-17(8-12)31-11-30-16/h1-10H,11H2,(H,26,28)(H,27,29)