4-[(E)-2-(4-dodecoxyphenyl)ethenyl]benzoic acid

Systemtic Name: 4-[(E)-2-(4-dodecoxyphenyl)ethenyl]benzoic acid Openeye Name: 4-[(E)-2-(4-dodecoxyphenyl)vinyl]benzoic acid CAS Name: 4-[(E)-2-(4-dodecoxyphenyl)ethenyl]benzoic acid IUPAC Name: 4-[(E)-2-(4-dodecoxyphenyl)ethenyl]benzoic acid Traditional Name: 4-[(E)-2-(4-lauryloxyphenyl)vinyl]benzoic acid Formula: C27H36O3 MolecularWeight: 408.57294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C=CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C27H36O3/c1-2-3-4-5-6-7-8-9-10-11-22-30-26-20-16-24(17-21-26)13-12-23-14-18-25(19-15-23)27(28)29/h12-21H,2-11,22H2,1H3,(H,28,29)/b13-12+