5-tert-butyl-2-(2,2-dimethylpropyl)benzoate

Systemtic Name: 5-tert-butyl-2-(2,2-dimethylpropyl)benzoate Openeye Name: 5-tert-butyl-2-(2,2-dimethylpropyl)benzoate CAS Name: 5-tert-butyl-2-(2,2-dimethylpropyl)benzoate IUPAC Name: 5-tert-butyl-2-(2,2-dimethylpropyl)benzoate Traditional Name: 5-tert-butyl-2-neopentyl-benzoate Formula: C16H23O2- MolecularWeight: 247.35262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=C(C=C(C=C1)C(C)(C)C)C(=O)[O-]

Isomeric SMILES

CC(C)(C)CC1=C(C=C(C=C1)C(C)(C)C)C(=O)[O-]

InChI

InChI=1S/C16H24O2/c1-15(2,3)10-11-7-8-12(16(4,5)6)9-13(11)14(17)18/h7-9H,10H2,1-6H3,(H,17,18)/p-1