5-hexadecoxybenzene-1,3-dicarboxylic acid

Systemtic Name: 5-hexadecoxybenzene-1,3-dicarboxylic acid Openeye Name: 5-hexadecoxybenzene-1,3-dicarboxylic acid CAS Name: 5-hexadecoxybenzene-1,3-dicarboxylic acid IUPAC Name: 5-hexadecoxybenzene-1,3-dicarboxylic acid Traditional Name: 5-cetyloxyisophthalic acid Formula: C24H38O5 MolecularWeight: 406.55552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC(=CC(=C1)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC(=CC(=C1)C(=O)O)C(=O)O

InChI

InChI=1S/C24H38O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-29-22-18-20(23(25)26)17-21(19-22)24(27)28/h17-19H,2-16H2,1H3,(H,25,26)(H,27,28)