2-butyl-2-[4-(oxan-2-yloxy)butyl]propanedioic acid

Systemtic Name: 2-butyl-2-[4-(oxan-2-yloxy)butyl]propanedioic acid Openeye Name: 2-butyl-2-(4-tetrahydropyran-2-yloxybutyl)propanedioic acid CAS Name: 2-butyl-2-[4-(2-oxanyloxy)butyl]propanedioic acid IUPAC Name: 2-butyl-2-[4-(oxan-2-yloxy)butyl]propanedioic acid Traditional Name: 2-butyl-2-(4-tetrahydropyran-2-yloxybutyl)malonic acid Formula: C16H28O6 MolecularWeight: 316.38992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCCOC1CCCCO1)(C(=O)O)C(=O)O

Isomeric SMILES

CCCCC(CCCCOC1CCCCO1)(C(=O)O)C(=O)O

InChI

InChI=1S/C16H28O6/c1-2-3-9-16(14(17)18,15(19)20)10-5-7-12-22-13-8-4-6-11-21-13/h13H,2-12H2,1H3,(H,17,18)(H,19,20)