2,6-dimethyl-4-oxidanylidene-heptanedioic acid

Systemtic Name: 2,6-dimethyl-4-oxidanylidene-heptanedioic acid Openeye Name: 2,6-dimethyl-4-oxo-heptanedioic acid CAS Name: 2,6-dimethyl-4-oxoheptanedioic acid IUPAC Name: 2,6-dimethyl-4-oxoheptanedioic acid Traditional Name: 4-keto-2,6-dimethyl-pimelic acid Formula: C9H14O5 MolecularWeight: 202.20446

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)CC(C)C(=O)O)C(=O)O

Isomeric SMILES

CC(CC(=O)CC(C)C(=O)O)C(=O)O

InChI

InChI=1S/C9H14O5/c1-5(8(11)12)3-7(10)4-6(2)9(13)14/h5-6H,3-4H2,1-2H3,(H,11,12)(H,13,14)