3-(4,4-dicyclopropyl-2-oxidanylidene-1H-3,1-benzoxazin-6-yl)-5-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-(4,4-dicyclopropyl-2-oxidanylidene-1H-3,1-benzoxazin-6-yl)-5-fluoranyl-benzenecarbonitrile Openeye Name: 3-(4,4-dicyclopropyl-2-oxo-1H-3,1-benzoxazin-6-yl)-5-fluoro-benzonitrile CAS Name: 3-(4,4-dicyclopropyl-2-oxo-1H-3,1-benzoxazin-6-yl)-5-fluorobenzonitrile IUPAC Name: 3-(4,4-dicyclopropyl-2-oxo-1H-3,1-benzoxazin-6-yl)-5-fluorobenzonitrile Traditional Name: 3-(4,4-dicyclopropyl-2-keto-1H-3,1-benzoxazin-6-yl)-5-fluoro-benzonitrile Formula: C21H17FN2O2 MolecularWeight: 348.370283

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2(C3=C(C=CC(=C3)C4=CC(=CC(=C4)C#N)F)NC(=O)O2)C5CC5

Isomeric SMILES

C1CC1C2(C3=C(C=CC(=C3)C4=CC(=CC(=C4)C#N)F)NC(=O)O2)C5CC5

InChI

InChI=1S/C21H17FN2O2/c22-17-8-12(11-23)7-14(9-17)13-1-6-19-18(10-13)21(15-2-3-15,16-4-5-16)26-20(25)24-19/h1,6-10,15-16H,2-5H2,(H,24,25)