5-tert-butyl-2-methyl-6-oxidanyl-3-(2-phenylpropan-2-yl)benzoic acid

Systemtic Name: 5-tert-butyl-2-methyl-6-oxidanyl-3-(2-phenylpropan-2-yl)benzoic acid Openeye Name: 3-tert-butyl-2-hydroxy-6-methyl-5-(1-methyl-1-phenyl-ethyl)benzoic acid CAS Name: 3-tert-butyl-2-hydroxy-6-methyl-5-(2-phenylpropan-2-yl)benzoic acid IUPAC Name: 3-tert-butyl-2-hydroxy-6-methyl-5-(2-phenylpropan-2-yl)benzoic acid Traditional Name: 3-tert-butyl-5-cumyl-2-hydroxy-6-methyl-benzoic acid Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C(C)(C)C2=CC=CC=C2)C(C)(C)C)O)C(=O)O

Isomeric SMILES

CC1=C(C(=C(C=C1C(C)(C)C2=CC=CC=C2)C(C)(C)C)O)C(=O)O

InChI

InChI=1S/C21H26O3/c1-13-15(21(5,6)14-10-8-7-9-11-14)12-16(20(2,3)4)18(22)17(13)19(23)24/h7-12,22H,1-6H3,(H,23,24)