[(3S)-4-cyano-4-methyl-1-phenylmethoxy-pentan-3-yl] ethanoate

Systemtic Name: [(3S)-4-cyano-4-methyl-1-phenylmethoxy-pentan-3-yl] ethanoate Openeye Name: [(1S)-1-(2-benzyloxyethyl)-2-cyano-2-methyl-propyl] acetate CAS Name: acetic acid [(3S)-4-cyano-4-methyl-1-phenylmethoxypentan-3-yl] ester IUPAC Name: [(3S)-4-cyano-4-methyl-1-phenylmethoxypentan-3-yl] acetate Traditional Name: acetic acid [(1S)-1-(2-benzoxyethyl)-2-cyano-2-methyl-propyl] ester Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CCOCC1=CC=CC=C1)C(C)(C)C#N

Isomeric SMILES

CC(=O)O[C@@H](CCOCC1=CC=CC=C1)C(C)(C)C#N

InChI

InChI=1S/C16H21NO3/c1-13(18)20-15(16(2,3)12-17)9-10-19-11-14-7-5-4-6-8-14/h4-8,15H,9-11H2,1-3H3/t15-/m0/s1