3-[4-(2-tert-butyl-4-methyl-phenoxy)phenyl]propanoic acid

Systemtic Name: 3-[4-(2-tert-butyl-4-methyl-phenoxy)phenyl]propanoic acid Openeye Name: 3-[4-(2-tert-butyl-4-methyl-phenoxy)phenyl]propanoic acid CAS Name: 3-[4-(2-tert-butyl-4-methylphenoxy)phenyl]propanoic acid IUPAC Name: 3-[4-(2-tert-butyl-4-methylphenoxy)phenyl]propanoic acid Traditional Name: 3-[4-(2-tert-butyl-4-methyl-phenoxy)phenyl]propionic acid Formula: C20H24O3 MolecularWeight: 312.40276

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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)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C20H24O3/c1-14-5-11-18(17(13-14)20(2,3)4)23-16-9-6-15(7-10-16)8-12-19(21)22/h5-7,9-11,13H,8,12H2,1-4H3,(H,21,22)