[(2S)-2-(phenylmethyl)butyl] ethanoate

Systemtic Name: [(2S)-2-(phenylmethyl)butyl] ethanoate Openeye Name: [(2S)-2-benzylbutyl] acetate CAS Name: acetic acid [(2S)-2-(phenylmethyl)butyl] ester IUPAC Name: [(2S)-2-benzylbutyl] acetate Traditional Name: acetic acid [(2S)-2-benzylbutyl] ester Formula: C13H18O2 MolecularWeight: 206.28082

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)COC(=O)C

Isomeric SMILES

CC[C@@H](CC1=CC=CC=C1)COC(=O)C

InChI

InChI=1S/C13H18O2/c1-3-12(10-15-11(2)14)9-13-7-5-4-6-8-13/h4-8,12H,3,9-10H2,1-2H3/t12-/m0/s1