(2S)-2-(3-ethanoylphenoxy)-3-methyl-butanoic acid

Systemtic Name: (2S)-2-(3-ethanoylphenoxy)-3-methyl-butanoic acid Openeye Name: (2S)-2-(3-acetylphenoxy)-3-methyl-butanoic acid CAS Name: (2S)-2-(3-acetylphenoxy)-3-methylbutanoic acid IUPAC Name: (2S)-2-(3-acetylphenoxy)-3-methylbutanoic acid Traditional Name: (2S)-2-(3-acetylphenoxy)-3-methyl-butyric acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)[C@@H](C(=O)O)OC1=CC=CC(=C1)C(=O)C

InChI

InChI=1S/C13H16O4/c1-8(2)12(13(15)16)17-11-6-4-5-10(7-11)9(3)14/h4-8,12H,1-3H3,(H,15,16)/t12-/m0/s1