[(2S,3S)-2-methyl-1-phenyl-octan-3-yl] ethanoate

Systemtic Name: [(2S,3S)-2-methyl-1-phenyl-octan-3-yl] ethanoate Openeye Name: [(1S)-1-[(1S)-1-methyl-2-phenyl-ethyl]hexyl] acetate CAS Name: acetic acid [(2S,3S)-2-methyl-1-phenyloctan-3-yl] ester IUPAC Name: [(2S,3S)-2-methyl-1-phenyloctan-3-yl] acetate Traditional Name: acetic acid [(1S)-1-[(1S)-1-methyl-2-phenyl-ethyl]hexyl] ester Formula: C17H26O2 MolecularWeight: 262.38714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(C)CC1=CC=CC=C1)OC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C17H26O2/c1-4-5-7-12-17(19-15(3)18)14(2)13-16-10-8-6-9-11-16/h6,8-11,14,17H,4-5,7,12-13H2,1-3H3/t14-,17-/m0/s1