(2E,4E)-3-methyl-5-(2,6,6-trimethyl-3-oxidanyl-cyclohexen-1-yl)penta-2,4-dienenitrile

Systemtic Name: (2E,4E)-3-methyl-5-(2,6,6-trimethyl-3-oxidanyl-cyclohexen-1-yl)penta-2,4-dienenitrile Openeye Name: (2E,4E)-5-(3-hydroxy-2,6,6-trimethyl-cyclohexen-1-yl)-3-methyl-penta-2,4-dienenitrile CAS Name: (2E,4E)-5-(3-hydroxy-2,6,6-trimethyl-1-cyclohexenyl)-3-methylpenta-2,4-dienenitrile IUPAC Name: (2E,4E)-5-(3-hydroxy-2,6,6-trimethylcyclohexen-1-yl)-3-methylpenta-2,4-dienenitrile Traditional Name: (2E,4E)-5-(3-hydroxy-2,6,6-trimethyl-cyclohexen-1-yl)-3-methyl-penta-2,4-dienenitrile Formula: C15H21NO MolecularWeight: 231.33334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1O)(C)C)C=CC(=CC#N)C

Isomeric SMILES

CC1=C(C(CCC1O)(C)C)/C=C/C(=C/C#N)/C

InChI

InChI=1S/C15H21NO/c1-11(8-10-16)5-6-13-12(2)14(17)7-9-15(13,3)4/h5-6,8,14,17H,7,9H2,1-4H3/b6-5+,11-8+