3,4-bis(octoxycarbonyl)benzoic acid

Systemtic Name: 3,4-bis(octoxycarbonyl)benzoic acid Openeye Name: 3,4-bis(octoxycarbonyl)benzoic acid CAS Name: 3,4-bis[octoxy(oxo)methyl]benzoic acid IUPAC Name: 3,4-bis(octoxycarbonyl)benzoic acid Traditional Name: 3,4-bis(octoxycarbonyl)benzoic acid Formula: C25H38O6 MolecularWeight: 434.56562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H38O6/c1-3-5-7-9-11-13-17-30-24(28)21-16-15-20(23(26)27)19-22(21)25(29)31-18-14-12-10-8-6-4-2/h15-16,19H,3-14,17-18H2,1-2H3,(H,26,27)