IUPAC Name: | 5-methyl-2-(2-methylphenyl)hexanoic acid |
Description: | 5-Methyl-2-(2-tolyl)hexanoic Acid is an intermediate in the synthetic preparation of phenylpiperidine derivatives as NK1 and NK3 antagonists used to treat neurokinin-mediated diseases. |
Molecular Weight: | 220.31 |
Molecular Formula: | C14H20O2 |
Canonical SMILES: | CC1=CC=CC=C1C(CCC(C)C)C(=O)O |
InChI: | InChI=1S/C14H20O2/c1-10(2)8-9-13(14(15)16)12-7-5-4-6-11(12)3/h4-7,10,13H,8-9H2,1-3H3,(H,15,16) |
InChI Key: | MNELGDYQFVCTGL-UHFFFAOYSA-N |
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