4-butan-2-yl-2,6-dimethyl-benzoic acid

Systemtic Name: 4-butan-2-yl-2,6-dimethyl-benzoic acid Openeye Name: 2,6-dimethyl-4-sec-butyl-benzoic acid CAS Name: 4-butan-2-yl-2,6-dimethylbenzoic acid IUPAC Name: 4-butan-2-yl-2,6-dimethylbenzoic acid Traditional Name: 2,6-dimethyl-4-sec-butyl-benzoic acid Formula: C13H18O2 MolecularWeight: 206.28082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O2/c1-5-8(2)11-6-9(3)12(13(14)15)10(4)7-11/h6-8H,5H2,1-4H3,(H,14,15)