2-[2,2-bis(2-ethylhexoxy)ethoxycarbonyl]benzoic acid

Systemtic Name: 2-[2,2-bis(2-ethylhexoxy)ethoxycarbonyl]benzoic acid Openeye Name: 2-[2,2-bis(2-ethylhexoxy)ethoxycarbonyl]benzoic acid CAS Name: 2-[2,2-bis(2-ethylhexoxy)ethoxy-oxomethyl]benzoic acid IUPAC Name: 2-[2,2-bis(2-ethylhexoxy)ethoxycarbonyl]benzoic acid Traditional Name: 2-[2,2-bis(2-ethylhexoxy)ethoxycarbonyl]benzoic acid Formula: C26H42O6 MolecularWeight: 450.60808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(COC(=O)C1=CC=CC=C1C(=O)O)OCC(CC)CCCC

Isomeric SMILES

CCCCC(CC)COC(COC(=O)C1=CC=CC=C1C(=O)O)OCC(CC)CCCC

InChI

InChI=1S/C26H42O6/c1-5-9-13-20(7-3)17-30-24(31-18-21(8-4)14-10-6-2)19-32-26(29)23-16-12-11-15-22(23)25(27)28/h11-12,15-16,20-21,24H,5-10,13-14,17-19H2,1-4H3,(H,27,28)