[5-(3-methoxyphenyl)-5-oxidanyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(2-nitrophenyl)methanone

Systemtic Name: [5-(3-methoxyphenyl)-5-oxidanyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(2-nitrophenyl)methanone Openeye Name: [5-hydroxy-5-(3-methoxyphenyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(2-nitrophenyl)methanone CAS Name: [5-hydroxy-5-(3-methoxyphenyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(2-nitrophenyl)methanone IUPAC Name: [5-hydroxy-5-(3-methoxyphenyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(2-nitrophenyl)methanone Traditional Name: [5-hydroxy-5-(3-methoxyphenyl)-3-(trifluoromethyl)-2-pyrazolin-1-yl]-(2-nitrophenyl)methanone Formula: C18H14F3N3O5 MolecularWeight: 409.31607

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2(CC(=NN2C(=O)C3=CC=CC=C3[N+](=O)[O-])C(F)(F)F)O

Isomeric SMILES

COC1=CC=CC(=C1)C2(CC(=NN2C(=O)C3=CC=CC=C3[N+](=O)[O-])C(F)(F)F)O

InChI

InChI=1S/C18H14F3N3O5/c1-29-12-6-4-5-11(9-12)17(26)10-15(18(19,20)21)22-23(17)16(25)13-7-2-3-8-14(13)24(27)28/h2-9,26H,10H2,1H3