[(2S)-1-(cyclohexylamino)propan-2-yl] benzoate

Systemtic Name: [(2S)-1-(cyclohexylamino)propan-2-yl] benzoate Openeye Name: [(1S)-2-(cyclohexylamino)-1-methyl-ethyl] benzoate CAS Name: benzoic acid [(2S)-1-(cyclohexylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-(cyclohexylamino)propan-2-yl] benzoate Traditional Name: benzoic acid [(1S)-2-(cyclohexylamino)-1-methyl-ethyl] ester Formula: C16H23NO2 MolecularWeight: 261.35932

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1CCCCC1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](CNC1CCCCC1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H23NO2/c1-13(12-17-15-10-6-3-7-11-15)19-16(18)14-8-4-2-5-9-14/h2,4-5,8-9,13,15,17H,3,6-7,10-12H2,1H3/t13-/m0/s1