2-(4-methoxyphenyl)-4-methyl-pentanoic acid

Systemtic Name: 2-(4-methoxyphenyl)-4-methyl-pentanoic acid Openeye Name: 2-(4-methoxyphenyl)-4-methyl-pentanoic acid CAS Name: 2-(4-methoxyphenyl)-4-methylpentanoic acid IUPAC Name: 2-(4-methoxyphenyl)-4-methylpentanoic acid Traditional Name: 2-(4-methoxyphenyl)-4-methyl-valeric acid Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=C(C=C1)OC)C(=O)O

Isomeric SMILES

CC(C)CC(C1=CC=C(C=C1)OC)C(=O)O

InChI

InChI=1S/C13H18O3/c1-9(2)8-12(13(14)15)10-4-6-11(16-3)7-5-10/h4-7,9,12H,8H2,1-3H3,(H,14,15)