5-(2-methylbutan-2-yl)-2-oxidanyl-3-(2-phenylpropan-2-yl)benzoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26O3/c1-6-20(2,3)15-12-16(19(23)24)18(22)17(13-15)21(4,5)14-10-8-7-9-11-14/h7-13,22H,6H2,1-5H3,(H,23,24)