4-[(E)-2-(2,2-dimethylpropanoyl)-4,4-dimethyl-3-oxidanyl-pent-2-enyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-2-(2,2-dimethylpropanoyl)-4,4-dimethyl-3-oxidanyl-pent-2-enyl]benzenecarbonitrile Openeye Name: 4-[(E)-2-(2,2-dimethylpropanoyl)-3-hydroxy-4,4-dimethyl-pent-2-enyl]benzonitrile CAS Name: 4-[(E)-2-(2,2-dimethyl-1-oxopropyl)-3-hydroxy-4,4-dimethylpent-2-enyl]benzonitrile IUPAC Name: 4-[(E)-2-(2,2-dimethylpropanoyl)-3-hydroxy-4,4-dimethylpent-2-enyl]benzonitrile Traditional Name: 4-[(E)-3-hydroxy-4,4-dimethyl-2-pivaloyl-pent-2-enyl]benzonitrile Formula: C19H25NO2 MolecularWeight: 299.4073

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=C(CC1=CC=C(C=C1)C#N)C(=O)C(C)(C)C)O

Isomeric SMILES

CC(C)(C)/C(=C(/CC1=CC=C(C=C1)C#N)\C(=O)C(C)(C)C)/O

InChI

InChI=1S/C19H25NO2/c1-18(2,3)16(21)15(17(22)19(4,5)6)11-13-7-9-14(12-20)10-8-13/h7-10,21H,11H2,1-6H3/b16-15+