3-icosylphthalic acid

Systemtic Name: 3-icosylphthalic acid Openeye Name: 3-icosylphthalic acid CAS Name: 3-eicosylphthalic acid IUPAC Name: 3-icosylphthalic acid Traditional Name: 3-arachylphthalic acid Formula: C28H46O4 MolecularWeight: 446.66244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCC1=CC=CC(=C1C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCC1=CC=CC(=C1C(=O)O)C(=O)O

InChI

InChI=1S/C28H46O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-24-22-20-23-25(27(29)30)26(24)28(31)32/h20,22-23H,2-19,21H2,1H3,(H,29,30)(H,31,32)