1,4-diethanoyl-2-phenyl-2-[[4-(trifluoromethyl)phenyl]amino]pyrazol-2-ium-3-one

Systemtic Name: 1,4-diethanoyl-2-phenyl-2-[[4-(trifluoromethyl)phenyl]amino]pyrazol-2-ium-3-one Openeye Name: 1,4-diacetyl-2-phenyl-2-[4-(trifluoromethyl)anilino]pyrazol-2-ium-3-one CAS Name: 1,4-diacetyl-2-phenyl-2-[4-(trifluoromethyl)anilino]-3-pyrazol-2-iumone IUPAC Name: 1,4-diacetyl-2-phenyl-2-[4-(trifluoromethyl)anilino]pyrazol-2-ium-3-one Traditional Name: 1,4-diacetyl-2-phenyl-2-[4-(trifluoromethyl)anilino]-3-pyrazolin-2-ium-3-one Formula: C20H17F3N3O3+ MolecularWeight: 404.36249

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN([N+](C1=O)(C2=CC=CC=C2)NC3=CC=C(C=C3)C(F)(F)F)C(=O)C

Isomeric SMILES

CC(=O)C1=CN([N+](C1=O)(C2=CC=CC=C2)NC3=CC=C(C=C3)C(F)(F)F)C(=O)C

InChI

InChI=1S/C20H17F3N3O3/c1-13(27)18-12-25(14(2)28)26(19(18)29,17-6-4-3-5-7-17)24-16-10-8-15(9-11-16)20(21,22)23/h3-12,24H,1-2H3/q+1