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

Systemtic Name: 4-(4-hexadecoxyphenyl)-2-methyl-buta-2,3-dienoic acid Openeye Name: 4-(4-hexadecoxyphenyl)-2-methyl-buta-2,3-dienoic acid CAS Name: 4-(4-hexadecoxyphenyl)-2-methylbuta-2,3-dienoic acid IUPAC Name: 4-(4-hexadecoxyphenyl)-2-methylbuta-2,3-dienoic acid Traditional Name: 4-(4-cetyloxyphenyl)-2-methyl-buta-2,3-dienoic acid Formula: C27H42O3 MolecularWeight: 414.62058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C=C=C(C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C=C=C(C)C(=O)O

InChI

InChI=1S/C27H42O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-30-26-21-19-25(20-22-26)18-17-24(2)27(28)29/h18-22H,3-16,23H2,1-2H3,(H,28,29)