2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-nitro-2-oxidanyl-phenyl)propanamide

Systemtic Name: 2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-nitro-2-oxidanyl-phenyl)propanamide Openeye Name: 2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-hydroxy-4-nitro-phenyl)propanamide CAS Name: 2-[5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]-N-(2-hydroxy-4-nitrophenyl)propanamide IUPAC Name: 2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-hydroxy-4-nitrophenyl)propanamide Traditional Name: 2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-hydroxy-4-nitro-phenyl)propionamide Formula: C16H15F3N4O4 MolecularWeight: 384.30991

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])O)N2C(=CC(=N2)C(F)(F)F)C3CC3

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])O)N2C(=CC(=N2)C(F)(F)F)C3CC3

InChI

InChI=1S/C16H15F3N4O4/c1-8(15(25)20-11-5-4-10(23(26)27)6-13(11)24)22-12(9-2-3-9)7-14(21-22)16(17,18)19/h4-9,24H,2-3H2,1H3,(H,20,25)