4-[(E)-4,4-dimethyl-3-oxidanyl-pent-1-enyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-4,4-dimethyl-3-oxidanyl-pent-1-enyl]benzenecarbonitrile Openeye Name: 4-[(E)-3-hydroxy-4,4-dimethyl-pent-1-enyl]benzonitrile CAS Name: 4-[(E)-3-hydroxy-4,4-dimethylpent-1-enyl]benzonitrile IUPAC Name: 4-[(E)-3-hydroxy-4,4-dimethylpent-1-enyl]benzonitrile Traditional Name: 4-[(E)-3-hydroxy-4,4-dimethyl-pent-1-enyl]benzonitrile Formula: C14H17NO MolecularWeight: 215.29088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO/c1-14(2,3)13(16)9-8-11-4-6-12(10-15)7-5-11/h4-9,13,16H,1-3H3/b9-8+