3-(2,4,4-trimethylpentan-2-yl)benzoic acid

Systemtic Name: 3-(2,4,4-trimethylpentan-2-yl)benzoic acid Openeye Name: 3-(1,1,3,3-tetramethylbutyl)benzoic acid CAS Name: 3-(2,4,4-trimethylpentan-2-yl)benzoic acid IUPAC Name: 3-(2,4,4-trimethylpentan-2-yl)benzoic acid Traditional Name: 3-(1,1,3,3-tetramethylbutyl)benzoic acid Formula: C15H22O2 MolecularWeight: 234.33398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)C1=CC=CC(=C1)C(=O)O

Isomeric SMILES

CC(C)(C)CC(C)(C)C1=CC=CC(=C1)C(=O)O

InChI

InChI=1S/C15H22O2/c1-14(2,3)10-15(4,5)12-8-6-7-11(9-12)13(16)17/h6-9H,10H2,1-5H3,(H,16,17)