5-(1-ethoxy-12-methyl-1-oxidanylidene-tridecan-3-yl)oxy-3-methyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-(1-ethoxy-12-methyl-1-oxidanylidene-tridecan-3-yl)oxy-3-methyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-[1-(2-ethoxy-2-oxo-ethyl)-10-methyl-undecoxy]-3-methyl-5-oxo-pentanoic acid CAS Name: 5-(1-ethoxy-12-methyl-1-oxotridecan-3-yl)oxy-3-methyl-5-oxopentanoic acid IUPAC Name: 5-(1-ethoxy-12-methyl-1-oxotridecan-3-yl)oxy-3-methyl-5-oxopentanoic acid Traditional Name: 5-[1-(2-ethoxy-2-keto-ethyl)-10-methyl-undecoxy]-5-keto-3-methyl-valeric acid Formula: C22H40O6 MolecularWeight: 400.5494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CCCCCCCCC(C)C)OC(=O)CC(C)CC(=O)O

Isomeric SMILES

CCOC(=O)CC(CCCCCCCCC(C)C)OC(=O)CC(C)CC(=O)O

InChI

InChI=1S/C22H40O6/c1-5-27-21(25)16-19(28-22(26)15-18(4)14-20(23)24)13-11-9-7-6-8-10-12-17(2)3/h17-19H,5-16H2,1-4H3,(H,23,24)