2-tert-butyl-4-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-5-(trifluoromethyl)pyrazol-3-one

Systemtic Name: 2-tert-butyl-4-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-5-(trifluoromethyl)pyrazol-3-one Openeye Name: 2-tert-butyl-4-(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-5-(trifluoromethyl)pyrazol-3-one CAS Name: 2-tert-butyl-4-(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)-5-(trifluoromethyl)-3-pyrazolone IUPAC Name: 2-tert-butyl-4-(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-5-(trifluoromethyl)pyrazol-3-one Traditional Name: 2-tert-butyl-4-(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)-5-(trifluoromethyl)-2-pyrazolin-3-one Formula: C22H29F3N2O2 MolecularWeight: 410.47307

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C(=NN(C2=O)C(C)(C)C)C(F)(F)F)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2C(=NN(C2=O)C(C)(C)C)C(F)(F)F)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C22H29F3N2O2/c1-19(2,3)13-10-12(11-14(16(13)28)20(4,5)6)15-17(22(23,24)25)26-27(18(15)29)21(7,8)9/h10-11H,1-9H3