(2E,4E)-5-[3-(3-tert-butyl-2-propoxy-5-propyl-phenyl)thiophen-2-yl]-3-methyl-penta-2,4-dienoic acid

Systemtic Name: (2E,4E)-5-[3-(3-tert-butyl-2-propoxy-5-propyl-phenyl)thiophen-2-yl]-3-methyl-penta-2,4-dienoic acid Openeye Name: (2E,4E)-5-[3-(3-tert-butyl-2-propoxy-5-propyl-phenyl)-2-thienyl]-3-methyl-penta-2,4-dienoic acid CAS Name: (2E,4E)-5-[3-(3-tert-butyl-2-propoxy-5-propylphenyl)-2-thiophenyl]-3-methylpenta-2,4-dienoic acid IUPAC Name: (2E,4E)-5-[3-(3-tert-butyl-2-propoxy-5-propylphenyl)thiophen-2-yl]-3-methylpenta-2,4-dienoic acid Traditional Name: (2E,4E)-5-[3-(3-tert-butyl-2-propoxy-5-propyl-phenyl)-2-thienyl]-3-methyl-penta-2,4-dienoic acid Formula: C26H34O3S MolecularWeight: 426.61136

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C(=C1)C2=C(SC=C2)C=CC(=CC(=O)O)C)OCCC)C(C)(C)C

Isomeric SMILES

CCCC1=CC(=C(C(=C1)C2=C(SC=C2)/C=C/C(=C/C(=O)O)/C)OCCC)C(C)(C)C

InChI

InChI=1S/C26H34O3S/c1-7-9-19-16-21(25(29-13-8-2)22(17-19)26(4,5)6)20-12-14-30-23(20)11-10-18(3)15-24(27)28/h10-12,14-17H,7-9,13H2,1-6H3,(H,27,28)/b11-10+,18-15+