N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-9-oxidanylidene-bicyclo[3.3.1]nonane-3-carboxamide

Systemtic Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-9-oxidanylidene-bicyclo[3.3.1]nonane-3-carboxamide Openeye Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-9-oxo-bicyclo[3.3.1]nonane-3-carboxamide CAS Name: N-[5-tert-butyl-2-(4-fluorophenyl)-3-pyrazolyl]-9-oxo-3-bicyclo[3.3.1]nonanecarboxamide IUPAC Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-9-oxobicyclo[3.3.1]nonane-3-carboxamide Traditional Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-9-keto-bicyclo[3.3.1]nonane-3-carboxamide Formula: C23H28FN3O2 MolecularWeight: 397.485723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)C2CC3CCCC(C2)C3=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)C2CC3CCCC(C2)C3=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H28FN3O2/c1-23(2,3)19-13-20(27(26-19)18-9-7-17(24)8-10-18)25-22(29)16-11-14-5-4-6-15(12-16)21(14)28/h7-10,13-16H,4-6,11-12H2,1-3H3,(H,25,29)