3-(4-iodanyl-5-methyl-pyrazol-1-yl)-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]propanamide

Systemtic Name: 3-(4-iodanyl-5-methyl-pyrazol-1-yl)-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]propanamide Openeye Name: 3-(4-iodo-5-methyl-pyrazol-1-yl)-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]propanamide CAS Name: 3-(4-iodo-5-methyl-1-pyrazolyl)-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]propanamide IUPAC Name: 3-(4-iodo-5-methylpyrazol-1-yl)-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]propanamide Traditional Name: 3-(4-iodo-5-methyl-pyrazol-1-yl)-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]propionamide Formula: C20H16F3IN4O4 MolecularWeight: 560.26512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1CCC(=O)NC2=CC(=CC(=C2)OC3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-])I

Isomeric SMILES

CC1=C(C=NN1CCC(=O)NC2=CC(=CC(=C2)OC3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-])I

InChI

InChI=1S/C20H16F3IN4O4/c1-12-18(24)11-25-27(12)6-5-19(29)26-14-8-15(28(30)31)10-17(9-14)32-16-4-2-3-13(7-16)20(21,22)23/h2-4,7-11H,5-6H2,1H3,(H,26,29)