4-[5-(4-tert-butylphenyl)-3-oxidanyl-pentyl]benzoic acid

Systemtic Name: 4-[5-(4-tert-butylphenyl)-3-oxidanyl-pentyl]benzoic acid Openeye Name: 4-[5-(4-tert-butylphenyl)-3-hydroxy-pentyl]benzoic acid CAS Name: 4-[5-(4-tert-butylphenyl)-3-hydroxypentyl]benzoic acid IUPAC Name: 4-[5-(4-tert-butylphenyl)-3-hydroxypentyl]benzoic acid Traditional Name: 4-[5-(4-tert-butylphenyl)-3-hydroxy-pentyl]benzoic acid Formula: C22H28O3 MolecularWeight: 340.45592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CCC(CCC2=CC=C(C=C2)C(=O)O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CCC(CCC2=CC=C(C=C2)C(=O)O)O

InChI

InChI=1S/C22H28O3/c1-22(2,3)19-12-6-17(7-13-19)9-15-20(23)14-8-16-4-10-18(11-5-16)21(24)25/h4-7,10-13,20,23H,8-9,14-15H2,1-3H3,(H,24,25)