2-methyl-4-(4-octadecoxyphenyl)buta-2,3-dienoic acid

Systemtic Name: 2-methyl-4-(4-octadecoxyphenyl)buta-2,3-dienoic acid Openeye Name: 2-methyl-4-(4-octadecoxyphenyl)buta-2,3-dienoic acid CAS Name: 2-methyl-4-(4-octadecoxyphenyl)buta-2,3-dienoic acid IUPAC Name: 2-methyl-4-(4-octadecoxyphenyl)buta-2,3-dienoic acid Traditional Name: 2-methyl-4-(4-stearyloxyphenyl)buta-2,3-dienoic acid Formula: C29H46O3 MolecularWeight: 442.67374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C=C=C(C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C=C=C(C)C(=O)O

InChI

InChI=1S/C29H46O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25-32-28-23-21-27(22-24-28)20-19-26(2)29(30)31/h20-24H,3-18,25H2,1-2H3,(H,30,31)