4,5-bis(2-ethylhexoxycarbonyl)phthalic acid

Systemtic Name: 4,5-bis(2-ethylhexoxycarbonyl)phthalic acid Openeye Name: 4,5-bis(2-ethylhexoxycarbonyl)phthalic acid CAS Name: 4,5-bis[2-ethylhexoxy(oxo)methyl]phthalic acid IUPAC Name: 4,5-bis(2-ethylhexoxycarbonyl)phthalic acid Traditional Name: 4,5-bis(2-ethylhexoxycarbonyl)phthalic acid Formula: C26H38O8 MolecularWeight: 478.57512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C1=C(C=C(C(=C1)C(=O)O)C(=O)O)C(=O)OCC(CC)CCCC

Isomeric SMILES

CCCCC(CC)COC(=O)C1=C(C=C(C(=C1)C(=O)O)C(=O)O)C(=O)OCC(CC)CCCC

InChI

InChI=1S/C26H38O8/c1-5-9-11-17(7-3)15-33-25(31)21-13-19(23(27)28)20(24(29)30)14-22(21)26(32)34-16-18(8-4)12-10-6-2/h13-14,17-18H,5-12,15-16H2,1-4H3,(H,27,28)(H,29,30)