4-oxidanyl-3-[(1E,6E)-3,7,10-trimethyl-3-oxidanyl-undeca-1,6,9-trienyl]benzenecarbonitrile

Systemtic Name: 4-oxidanyl-3-[(1E,6E)-3,7,10-trimethyl-3-oxidanyl-undeca-1,6,9-trienyl]benzenecarbonitrile Openeye Name: 4-hydroxy-3-[(1E,6E)-3-hydroxy-3,7,10-trimethyl-undeca-1,6,9-trienyl]benzonitrile CAS Name: 4-hydroxy-3-[(1E,6E)-3-hydroxy-3,7,10-trimethylundeca-1,6,9-trienyl]benzonitrile IUPAC Name: 4-hydroxy-3-[(1E,6E)-3-hydroxy-3,7,10-trimethylundeca-1,6,9-trienyl]benzonitrile Traditional Name: 4-hydroxy-3-[(1E,6E)-3-hydroxy-3,7,10-trimethyl-undeca-1,6,9-trienyl]benzonitrile Formula: C21H27NO2 MolecularWeight: 325.44458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27NO2/c1-16(2)7-8-17(3)6-5-12-21(4,24)13-11-19-14-18(15-22)9-10-20(19)23/h6-7,9-11,13-14,23-24H,5,8,12H2,1-4H3/b13-11+,17-6+