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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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