2-[4-[(2,3,6-trimethylphenoxy)methyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[(2,3,6-trimethylphenoxy)methyl]phenyl]ethanoic acid Openeye Name: 2-[4-[(2,3,6-trimethylphenoxy)methyl]phenyl]acetic acid CAS Name: 2-[4-[(2,3,6-trimethylphenoxy)methyl]phenyl]acetic acid IUPAC Name: 2-[4-[(2,3,6-trimethylphenoxy)methyl]phenyl]acetic acid Traditional Name: 2-[4-[(2,3,6-trimethylphenoxy)methyl]phenyl]acetic acid Formula: C18H20O3 MolecularWeight: 284.3496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCC2=CC=C(C=C2)CC(=O)O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OCC2=CC=C(C=C2)CC(=O)O)C

InChI

InChI=1S/C18H20O3/c1-12-4-5-13(2)18(14(12)3)21-11-16-8-6-15(7-9-16)10-17(19)20/h4-9H,10-11H2,1-3H3,(H,19,20)