5-octadecoxy-2-propoxy-benzoic acid

Systemtic Name: 5-octadecoxy-2-propoxy-benzoic acid Openeye Name: 5-octadecoxy-2-propoxy-benzoic acid CAS Name: 5-octadecoxy-2-propoxybenzoic acid IUPAC Name: 5-octadecoxy-2-propoxybenzoic acid Traditional Name: 2-propoxy-5-stearyloxy-benzoic acid Formula: C28H48O4 MolecularWeight: 448.67832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H48O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-31-25-20-21-27(32-22-4-2)26(24-25)28(29)30/h20-21,24H,3-19,22-23H2,1-2H3,(H,29,30)