[(1S)-1-phenylethyl] 3-methylbutanoate

Systemtic Name: [(1S)-1-phenylethyl] 3-methylbutanoate Openeye Name: [(1S)-1-phenylethyl] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [(1S)-1-phenylethyl] ester IUPAC Name: [(1S)-1-phenylethyl] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [(1S)-1-phenylethyl] ester Formula: C13H18O2 MolecularWeight: 206.28082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)OC(C)C1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C13H18O2/c1-10(2)9-13(14)15-11(3)12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3/t11-/m0/s1