6-acetyloxy-2-(7-methoxy-6-methyl-7-oxidanylidene-heptyl)undecanoic acid

Systemtic Name: 6-acetyloxy-2-(7-methoxy-6-methyl-7-oxidanylidene-heptyl)undecanoic acid Openeye Name: 6-acetoxy-2-(7-methoxy-6-methyl-7-oxo-heptyl)undecanoic acid CAS Name: 6-acetyloxy-2-(7-methoxy-6-methyl-7-oxoheptyl)undecanoic acid IUPAC Name: 6-acetyloxy-2-(7-methoxy-6-methyl-7-oxoheptyl)undecanoic acid Traditional Name: 6-acetoxy-2-(7-keto-7-methoxy-6-methyl-heptyl)undecanoic acid Formula: C22H40O6 MolecularWeight: 400.5494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCC(CCCCCC(C)C(=O)OC)C(=O)O)OC(=O)C

Isomeric SMILES

CCCCCC(CCCC(CCCCCC(C)C(=O)OC)C(=O)O)OC(=O)C

InChI

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