ethyl (4Z,6E,8E)-2,2,4-trimethyl-3-oxidanyl-10-phenyl-deca-4,6,8-trienoate

Systemtic Name: ethyl (4Z,6E,8E)-2,2,4-trimethyl-3-oxidanyl-10-phenyl-deca-4,6,8-trienoate Openeye Name: ethyl (4Z,6E,8E)-3-hydroxy-2,2,4-trimethyl-10-phenyl-deca-4,6,8-trienoate CAS Name: (4Z,6E,8E)-3-hydroxy-2,2,4-trimethyl-10-phenyldeca-4,6,8-trienoic acid ethyl ester IUPAC Name: ethyl (4Z,6E,8E)-3-hydroxy-2,2,4-trimethyl-10-phenyldeca-4,6,8-trienoate Traditional Name: (4Z,6E,8E)-3-hydroxy-2,2,4-trimethyl-10-phenyl-deca-4,6,8-trienoic acid ethyl ester Formula: C21H28O3 MolecularWeight: 328.44522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)C(C(=CC=CC=CCC1=CC=CC=C1)C)O

Isomeric SMILES

CCOC(=O)C(C)(C)C(/C(=C\C=C\C=C\CC1=CC=CC=C1)/C)O

InChI

InChI=1S/C21H28O3/c1-5-24-20(23)21(3,4)19(22)17(2)13-9-6-7-10-14-18-15-11-8-12-16-18/h6-13,15-16,19,22H,5,14H2,1-4H3/b9-6+,10-7+,17-13-