6-tert-butyl-1-(4-fluorophenyl)carbonyl-spiro[2.5]octane-2,2-dicarbonitrile

Systemtic Name: 6-tert-butyl-1-(4-fluorophenyl)carbonyl-spiro[2.5]octane-2,2-dicarbonitrile Openeye Name: 6-tert-butyl-1-(4-fluorobenzoyl)spiro[2.5]octane-2,2-dicarbonitrile CAS Name: 6-tert-butyl-1-[(4-fluorophenyl)-oxomethyl]spiro[2.5]octane-2,2-dicarbonitrile IUPAC Name: 6-tert-butyl-1-(4-fluorobenzoyl)spiro[2.5]octane-2,2-dicarbonitrile Traditional Name: 6-tert-butyl-1-(4-fluorobenzoyl)spiro[2.5]octane-2,2-dicarbonitrile Formula: C21H23FN2O MolecularWeight: 338.418523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2(CC1)C(C2(C#N)C#N)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)C1CCC2(CC1)C(C2(C#N)C#N)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H23FN2O/c1-19(2,3)15-8-10-20(11-9-15)18(21(20,12-23)13-24)17(25)14-4-6-16(22)7-5-14/h4-7,15,18H,8-11H2,1-3H3