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

Systemtic Name: 3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-methyl-4-nitro-phenyl)propanamide Openeye Name: 3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-methyl-4-nitro-phenyl)propanamide CAS Name: 3-[5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]-N-(2-methyl-4-nitrophenyl)propanamide IUPAC Name: 3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-methyl-4-nitrophenyl)propanamide Traditional Name: 3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-methyl-4-nitro-phenyl)propionamide Formula: C17H17F3N4O3 MolecularWeight: 382.33709

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CCN2C(=CC(=N2)C(F)(F)F)C3CC3

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CCN2C(=CC(=N2)C(F)(F)F)C3CC3

InChI

InChI=1S/C17H17F3N4O3/c1-10-8-12(24(26)27)4-5-13(10)21-16(25)6-7-23-14(11-2-3-11)9-15(22-23)17(18,19)20/h4-5,8-9,11H,2-3,6-7H2,1H3,(H,21,25)