2-(7-methoxy-6-methyl-7-oxidanylidene-heptyl)propanedioic acid

Systemtic Name: 2-(7-methoxy-6-methyl-7-oxidanylidene-heptyl)propanedioic acid Openeye Name: 2-(7-methoxy-6-methyl-7-oxo-heptyl)propanedioic acid CAS Name: 2-(7-methoxy-6-methyl-7-oxoheptyl)propanedioic acid IUPAC Name: 2-(7-methoxy-6-methyl-7-oxoheptyl)propanedioic acid Traditional Name: 2-(7-keto-7-methoxy-6-methyl-heptyl)malonic acid Formula: C12H20O6 MolecularWeight: 260.2836

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCC(C(=O)O)C(=O)O)C(=O)OC

Isomeric SMILES

CC(CCCCCC(C(=O)O)C(=O)O)C(=O)OC

InChI

InChI=1S/C12H20O6/c1-8(12(17)18-2)6-4-3-5-7-9(10(13)14)11(15)16/h8-9H,3-7H2,1-2H3,(H,13,14)(H,15,16)