2-(1,1-dioctadecoxyethoxycarbonyl)benzoic acid

Systemtic Name: 2-(1,1-dioctadecoxyethoxycarbonyl)benzoic acid Openeye Name: 2-(1,1-dioctadecoxyethoxycarbonyl)benzoic acid CAS Name: 2-[1,1-dioctadecoxyethoxy(oxo)methyl]benzoic acid IUPAC Name: 2-(1,1-dioctadecoxyethoxycarbonyl)benzoic acid Traditional Name: 2-(1,1-distearyloxyethoxycarbonyl)benzoic acid Formula: C46H82O6 MolecularWeight: 731.13968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(C)(OCCCCCCCCCCCCCCCCCC)OC(=O)C1=CC=CC=C1C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(C)(OCCCCCCCCCCCCCCCCCC)OC(=O)C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C46H82O6/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-36-40-50-46(3,52-45(49)43-39-35-34-38-42(43)44(47)48)51-41-37-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h34-35,38-39H,4-33,36-37,40-41H2,1-3H3,(H,47,48)