3-(4-octadecoxyphenyl)propanoic acid

Systemtic Name: 3-(4-octadecoxyphenyl)propanoic acid Openeye Name: 3-(4-octadecoxyphenyl)propanoic acid CAS Name: 3-(4-octadecoxyphenyl)propanoic acid IUPAC Name: 3-(4-octadecoxyphenyl)propanoic acid Traditional Name: 3-(4-stearyloxyphenyl)propionic acid Formula: C27H46O3 MolecularWeight: 418.65234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H46O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-30-26-21-18-25(19-22-26)20-23-27(28)29/h18-19,21-22H,2-17,20,23-24H2,1H3,(H,28,29)