2-nonadecylterephthalic acid

Systemtic Name: 2-nonadecylterephthalic acid Openeye Name: 2-nonadecylterephthalic acid CAS Name: 2-nonadecylterephthalic acid IUPAC Name: 2-nonadecylterephthalic acid Traditional Name: 2-nonadecylterephthalic acid Formula: C27H44O4 MolecularWeight: 432.63586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC1=C(C=CC(=C1)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC1=C(C=CC(=C1)C(=O)O)C(=O)O

InChI

InChI=1S/C27H44O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-22-24(26(28)29)20-21-25(23)27(30)31/h20-22H,2-19H2,1H3,(H,28,29)(H,30,31)