2-(5-methyl-3-oxidanylidene-hexyl)butanedioic acid

Systemtic Name: 2-(5-methyl-3-oxidanylidene-hexyl)butanedioic acid Openeye Name: 2-(5-methyl-3-oxo-hexyl)butanedioic acid CAS Name: 2-(5-methyl-3-oxohexyl)butanedioic acid IUPAC Name: 2-(5-methyl-3-oxohexyl)butanedioic acid Traditional Name: 2-(3-keto-5-methyl-hexyl)succinic acid Formula: C11H18O5 MolecularWeight: 230.25762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H18O5/c1-7(2)5-9(12)4-3-8(11(15)16)6-10(13)14/h7-8H,3-6H2,1-2H3,(H,13,14)(H,15,16)