2-(3,4-dimethyl-5-propan-2-yl-phenoxy)ethanoic acid

Systemtic Name: 2-(3,4-dimethyl-5-propan-2-yl-phenoxy)ethanoic acid Openeye Name: 2-(3-isopropyl-4,5-dimethyl-phenoxy)acetic acid CAS Name: 2-(3,4-dimethyl-5-propan-2-ylphenoxy)acetic acid IUPAC Name: 2-(3,4-dimethyl-5-propan-2-ylphenoxy)acetic acid Traditional Name: 2-(3-isopropyl-4,5-dimethyl-phenoxy)acetic acid Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)C(C)C)OCC(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1C)C(C)C)OCC(=O)O

InChI

InChI=1S/C13H18O3/c1-8(2)12-6-11(16-7-13(14)15)5-9(3)10(12)4/h5-6,8H,7H2,1-4H3,(H,14,15)