3-[2-(2-carboxyethyl)-3-methyl-cyclohexyl]propanoic acid

Systemtic Name: 3-[2-(2-carboxyethyl)-3-methyl-cyclohexyl]propanoic acid Openeye Name: 3-[2-(2-carboxyethyl)-3-methyl-cyclohexyl]propanoic acid CAS Name: 3-[2-(2-carboxyethyl)-3-methylcyclohexyl]propanoic acid IUPAC Name: 3-[2-(2-carboxyethyl)-3-methylcyclohexyl]propanoic acid Traditional Name: 3-[2-(2-carboxyethyl)-3-methyl-cyclohexyl]propionic acid Formula: C13H22O4 MolecularWeight: 242.31138

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1CCC(=O)O)CCC(=O)O

Isomeric SMILES

CC1CCCC(C1CCC(=O)O)CCC(=O)O

InChI

InChI=1S/C13H22O4/c1-9-3-2-4-10(5-7-12(14)15)11(9)6-8-13(16)17/h9-11H,2-8H2,1H3,(H,14,15)(H,16,17)