(E)-3-(3-nitrophenyl)-N-[4-pyrazol-1-yl-2-(trifluoromethyl)phenyl]prop-2-enamide

Systemtic Name: (E)-3-(3-nitrophenyl)-N-[4-pyrazol-1-yl-2-(trifluoromethyl)phenyl]prop-2-enamide Openeye Name: (E)-3-(3-nitrophenyl)-N-[4-pyrazol-1-yl-2-(trifluoromethyl)phenyl]prop-2-enamide CAS Name: (E)-3-(3-nitrophenyl)-N-[4-(1-pyrazolyl)-2-(trifluoromethyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(3-nitrophenyl)-N-[4-pyrazol-1-yl-2-(trifluoromethyl)phenyl]prop-2-enamide Traditional Name: (E)-3-(3-nitrophenyl)-N-[4-pyrazol-1-yl-2-(trifluoromethyl)phenyl]acrylamide Formula: C19H13F3N4O3 MolecularWeight: 402.32673

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=CC(=O)NC2=C(C=C(C=C2)N3C=CC=N3)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/C(=O)NC2=C(C=C(C=C2)N3C=CC=N3)C(F)(F)F

InChI

InChI=1S/C19H13F3N4O3/c20-19(21,22)16-12-14(25-10-2-9-23-25)6-7-17(16)24-18(27)8-5-13-3-1-4-15(11-13)26(28)29/h1-12H,(H,24,27)/b8-5+