(2Z,4E,6E)-4-butyl-2-(2-hexoxyphenyl)-3-methyl-octa-2,4,6-trienoic acid

Systemtic Name: (2Z,4E,6E)-4-butyl-2-(2-hexoxyphenyl)-3-methyl-octa-2,4,6-trienoic acid Openeye Name: (2Z,4E,6E)-4-butyl-2-(2-hexoxyphenyl)-3-methyl-octa-2,4,6-trienoic acid CAS Name: (2Z,4E,6E)-4-butyl-2-(2-hexoxyphenyl)-3-methylocta-2,4,6-trienoic acid IUPAC Name: (2Z,4E,6E)-4-butyl-2-(2-hexoxyphenyl)-3-methylocta-2,4,6-trienoic acid Traditional Name: (2Z,4E,6E)-4-butyl-2-(2-hexoxyphenyl)-3-methyl-octa-2,4,6-trienoic acid Formula: C25H36O3 MolecularWeight: 384.55154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=C(C)C(=CC=CC)CCCC)C(=O)O

Isomeric SMILES

CCCCCCOC1=CC=CC=C1/C(=C(\C)/C(=C/C=C/C)/CCCC)/C(=O)O

InChI

InChI=1S/C25H36O3/c1-5-8-11-14-19-28-23-18-13-12-17-22(23)24(25(26)27)20(4)21(15-9-6-2)16-10-7-3/h6,9,12-13,15,17-18H,5,7-8,10-11,14,16,19H2,1-4H3,(H,26,27)/b9-6+,21-15+,24-20-