(2S)-2-(3-methylbutoxy)-2-phenyl-ethanoate

Systemtic Name: (2S)-2-(3-methylbutoxy)-2-phenyl-ethanoate Openeye Name: (2S)-2-isopentyloxy-2-phenyl-acetate CAS Name: (2S)-2-(3-methylbutoxy)-2-phenylacetate IUPAC Name: (2S)-2-(3-methylbutoxy)-2-phenylacetate Traditional Name: (2S)-2-isoamoxy-2-phenyl-acetate Formula: C13H17O3- MolecularWeight: 221.27228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)CCO[C@@H](C1=CC=CC=C1)C(=O)[O-]

InChI

InChI=1S/C13H18O3/c1-10(2)8-9-16-12(13(14)15)11-6-4-3-5-7-11/h3-7,10,12H,8-9H2,1-2H3,(H,14,15)/p-1/t12-/m0/s1