3-tert-butyl-5-methyl-benzoate

Systemtic Name: 3-tert-butyl-5-methyl-benzoate Openeye Name: 3-tert-butyl-5-methyl-benzoate CAS Name: 3-tert-butyl-5-methylbenzoate IUPAC Name: 3-tert-butyl-5-methylbenzoate Traditional Name: 3-tert-butyl-5-methyl-benzoate Formula: C12H15O2- MolecularWeight: 191.2463

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16O2/c1-8-5-9(11(13)14)7-10(6-8)12(2,3)4/h5-7H,1-4H3,(H,13,14)/p-1