4-butyl-5,5-dimethyl-7-oxabicyclo[4.1.0]heptane-4-carboxylic acid

Systemtic Name: 4-butyl-5,5-dimethyl-7-oxabicyclo[4.1.0]heptane-4-carboxylic acid Openeye Name: 4-butyl-5,5-dimethyl-7-oxabicyclo[4.1.0]heptane-4-carboxylic acid CAS Name: 4-butyl-5,5-dimethyl-7-oxabicyclo[4.1.0]heptane-4-carboxylic acid IUPAC Name: 4-butyl-5,5-dimethyl-7-oxabicyclo[4.1.0]heptane-4-carboxylic acid Traditional Name: 4-butyl-5,5-dimethyl-7-oxabicyclo[4.1.0]heptane-4-carboxylic acid Formula: C13H22O3 MolecularWeight: 226.31198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CCC2C(C1(C)C)O2)C(=O)O

Isomeric SMILES

CCCCC1(CCC2C(C1(C)C)O2)C(=O)O

InChI

InChI=1S/C13H22O3/c1-4-5-7-13(11(14)15)8-6-9-10(16-9)12(13,2)3/h9-10H,4-8H2,1-3H3,(H,14,15)