4-phenylmethoxy-2-[(1E,6E)-3,7,11-trimethyl-3-oxidanyl-dodeca-1,6,10-trienyl]phenol

Systemtic Name: 4-phenylmethoxy-2-[(1E,6E)-3,7,11-trimethyl-3-oxidanyl-dodeca-1,6,10-trienyl]phenol Openeye Name: 4-benzyloxy-2-[(1E,6E)-3-hydroxy-3,7,11-trimethyl-dodeca-1,6,10-trienyl]phenol CAS Name: 2-[(1E,6E)-3-hydroxy-3,7,11-trimethyldodeca-1,6,10-trienyl]-4-phenylmethoxyphenol IUPAC Name: 2-[(1E,6E)-3-hydroxy-3,7,11-trimethyldodeca-1,6,10-trienyl]-4-phenylmethoxyphenol Traditional Name: 4-benzoxy-2-[(1E,6E)-3-hydroxy-3,7,11-trimethyl-dodeca-1,6,10-trienyl]phenol Formula: C28H36O3 MolecularWeight: 420.58364

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCCC(C)(C=CC1=C(C=CC(=C1)OCC2=CC=CC=C2)O)O)C)C

Isomeric SMILES

CC(=CCC/C(=C/CCC(C)(/C=C/C1=C(C=CC(=C1)OCC2=CC=CC=C2)O)O)/C)C

InChI

InChI=1S/C28H36O3/c1-22(2)10-8-11-23(3)12-9-18-28(4,30)19-17-25-20-26(15-16-27(25)29)31-21-24-13-6-5-7-14-24/h5-7,10,12-17,19-20,29-30H,8-9,11,18,21H2,1-4H3/b19-17+,23-12+