4-[(2,6-dimethylphenoxy)methyl]benzoic acid

Systemtic Name: 4-[(2,6-dimethylphenoxy)methyl]benzoic acid Openeye Name: 4-[(2,6-dimethylphenoxy)methyl]benzoic acid CAS Name: 4-[(2,6-dimethylphenoxy)methyl]benzoic acid IUPAC Name: 4-[(2,6-dimethylphenoxy)methyl]benzoic acid Traditional Name: 4-[(2,6-dimethylphenoxy)methyl]benzoic acid Formula: C16H16O3 MolecularWeight: 256.29644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16O3/c1-11-4-3-5-12(2)15(11)19-10-13-6-8-14(9-7-13)16(17)18/h3-9H,10H2,1-2H3,(H,17,18)