[4-nitro-3-propan-2-yl-2-(trifluoromethyl)phenyl]-(1,2-oxazol-3-yl)methanone

Systemtic Name: [4-nitro-3-propan-2-yl-2-(trifluoromethyl)phenyl]-(1,2-oxazol-3-yl)methanone Openeye Name: [3-isopropyl-4-nitro-2-(trifluoromethyl)phenyl]-isoxazol-3-yl-methanone CAS Name: 3-isoxazolyl-[4-nitro-3-propan-2-yl-2-(trifluoromethyl)phenyl]methanone IUPAC Name: [4-nitro-3-propan-2-yl-2-(trifluoromethyl)phenyl]-(1,2-oxazol-3-yl)methanone Traditional Name: [3-isopropyl-4-nitro-2-(trifluoromethyl)phenyl]-isoxazol-3-yl-methanone Formula: C14H11F3N2O4 MolecularWeight: 328.24335

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1C(F)(F)F)C(=O)C2=NOC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C=CC(=C1C(F)(F)F)C(=O)C2=NOC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H11F3N2O4/c1-7(2)11-10(19(21)22)4-3-8(12(11)14(15,16)17)13(20)9-5-6-23-18-9/h3-7H,1-2H3