2-(1,1-diethoxyoctadecan-2-yl)propanedioic acid

Systemtic Name: 2-(1,1-diethoxyoctadecan-2-yl)propanedioic acid Openeye Name: 2-[1-(diethoxymethyl)heptadecyl]propanedioic acid CAS Name: 2-(1,1-diethoxyoctadecan-2-yl)propanedioic acid IUPAC Name: 2-(1,1-diethoxyoctadecan-2-yl)propanedioic acid Traditional Name: 2-[1-(diethoxymethyl)heptadecyl]malonic acid Formula: C25H48O6 MolecularWeight: 444.64502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C(C(=O)O)C(=O)O)C(OCC)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C(C(=O)O)C(=O)O)C(OCC)OCC

InChI

InChI=1S/C25H48O6/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22(23(26)27)24(28)29)25(30-5-2)31-6-3/h21-22,25H,4-20H2,1-3H3,(H,26,27)(H,28,29)