3-acetyloxy-4-tert-butyl-benzoic acid

Systemtic Name: 3-acetyloxy-4-tert-butyl-benzoic acid Openeye Name: 3-acetoxy-4-tert-butyl-benzoic acid CAS Name: 3-acetyloxy-4-tert-butylbenzoic acid IUPAC Name: 3-acetyloxy-4-tert-butylbenzoic acid Traditional Name: 3-acetoxy-4-tert-butyl-benzoic acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=CC(=C1)C(=O)O)C(C)(C)C

Isomeric SMILES

CC(=O)OC1=C(C=CC(=C1)C(=O)O)C(C)(C)C

InChI

InChI=1S/C13H16O4/c1-8(14)17-11-7-9(12(15)16)5-6-10(11)13(2,3)4/h5-7H,1-4H3,(H,15,16)