4,5-bis(octoxycarbonyl)phthalic acid

Systemtic Name: 4,5-bis(octoxycarbonyl)phthalic acid Openeye Name: 4,5-bis(octoxycarbonyl)phthalic acid CAS Name: 4,5-bis[octoxy(oxo)methyl]phthalic acid IUPAC Name: 4,5-bis(octoxycarbonyl)phthalic acid Traditional Name: 4,5-bis(octoxycarbonyl)phthalic acid Formula: C26H38O8 MolecularWeight: 478.57512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=C(C=C(C(=C1)C(=O)O)C(=O)O)C(=O)OCCCCCCCC

Isomeric SMILES

CCCCCCCCOC(=O)C1=C(C=C(C(=C1)C(=O)O)C(=O)O)C(=O)OCCCCCCCC

InChI

InChI=1S/C26H38O8/c1-3-5-7-9-11-13-15-33-25(31)21-17-19(23(27)28)20(24(29)30)18-22(21)26(32)34-16-14-12-10-8-6-4-2/h17-18H,3-16H2,1-2H3,(H,27,28)(H,29,30)