3-[4-(2,3,5-trimethylphenoxy)phenyl]propanoic acid

Systemtic Name: 3-[4-(2,3,5-trimethylphenoxy)phenyl]propanoic acid Openeye Name: 3-[4-(2,3,5-trimethylphenoxy)phenyl]propanoic acid CAS Name: 3-[4-(2,3,5-trimethylphenoxy)phenyl]propanoic acid IUPAC Name: 3-[4-(2,3,5-trimethylphenoxy)phenyl]propanoic acid Traditional Name: 3-[4-(2,3,5-trimethylphenoxy)phenyl]propionic acid Formula: C18H20O3 MolecularWeight: 284.3496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC2=CC=C(C=C2)CCC(=O)O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OC2=CC=C(C=C2)CCC(=O)O)C)C

InChI

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