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

Systemtic Name: (2E,4E)-5-[3-(2-butoxy-5-tert-butyl-3-methyl-phenyl)thiophen-2-yl]-3-methyl-penta-2,4-dienoic acid Openeye Name: (2E,4E)-5-[3-(2-butoxy-5-tert-butyl-3-methyl-phenyl)-2-thienyl]-3-methyl-penta-2,4-dienoic acid CAS Name: (2E,4E)-5-[3-(2-butoxy-5-tert-butyl-3-methylphenyl)-2-thiophenyl]-3-methylpenta-2,4-dienoic acid IUPAC Name: (2E,4E)-5-[3-(2-butoxy-5-tert-butyl-3-methylphenyl)thiophen-2-yl]-3-methylpenta-2,4-dienoic acid Traditional Name: (2E,4E)-5-[3-(2-butoxy-5-tert-butyl-3-methyl-phenyl)-2-thienyl]-3-methyl-penta-2,4-dienoic acid Formula: C25H32O3S MolecularWeight: 412.58478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1C2=C(SC=C2)C=CC(=CC(=O)O)C)C(C)(C)C)C

Isomeric SMILES

CCCCOC1=C(C=C(C=C1C2=C(SC=C2)/C=C/C(=C/C(=O)O)/C)C(C)(C)C)C

InChI

InChI=1S/C25H32O3S/c1-7-8-12-28-24-18(3)15-19(25(4,5)6)16-21(24)20-11-13-29-22(20)10-9-17(2)14-23(26)27/h9-11,13-16H,7-8,12H2,1-6H3,(H,26,27)/b10-9+,17-14+