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

Systemtic Name: (2E,4E)-5-[3-(2-butoxy-3-cyclopentyl-5-ethyl-phenyl)thiophen-2-yl]-3-methyl-penta-2,4-dienoic acid Openeye Name: (2E,4E)-5-[3-(2-butoxy-3-cyclopentyl-5-ethyl-phenyl)-2-thienyl]-3-methyl-penta-2,4-dienoic acid CAS Name: (2E,4E)-5-[3-(2-butoxy-3-cyclopentyl-5-ethylphenyl)-2-thiophenyl]-3-methylpenta-2,4-dienoic acid IUPAC Name: (2E,4E)-5-[3-(2-butoxy-3-cyclopentyl-5-ethylphenyl)thiophen-2-yl]-3-methylpenta-2,4-dienoic acid Traditional Name: (2E,4E)-5-[3-(2-butoxy-3-cyclopentyl-5-ethyl-phenyl)-2-thienyl]-3-methyl-penta-2,4-dienoic acid Formula: C27H34O3S MolecularWeight: 438.62206

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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)CC)C3CCCC3

Isomeric SMILES

CCCCOC1=C(C=C(C=C1C2=C(SC=C2)/C=C/C(=C/C(=O)O)/C)CC)C3CCCC3

InChI

InChI=1S/C27H34O3S/c1-4-6-14-30-27-23(21-9-7-8-10-21)17-20(5-2)18-24(27)22-13-15-31-25(22)12-11-19(3)16-26(28)29/h11-13,15-18,21H,4-10,14H2,1-3H3,(H,28,29)/b12-11+,19-16+