[(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 2-(3,4-dimethylphenyl)ethanoate

Systemtic Name: [(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 2-(3,4-dimethylphenyl)ethanoate Openeye Name: [(1S)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl] 2-(3,4-dimethylphenyl)acetate CAS Name: 2-(3,4-dimethylphenyl)acetic acid [(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl] 2-(3,4-dimethylphenyl)acetate Traditional Name: 2-(3,4-dimethylphenyl)acetic acid [(1S)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H27NO3 MolecularWeight: 317.42258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC(=O)OC(C)C(=O)NC2CCCCC2)C

Isomeric SMILES

CC1=C(C=C(C=C1)CC(=O)O[C@@H](C)C(=O)NC2CCCCC2)C

InChI

InChI=1S/C19H27NO3/c1-13-9-10-16(11-14(13)2)12-18(21)23-15(3)19(22)20-17-7-5-4-6-8-17/h9-11,15,17H,4-8,12H2,1-3H3,(H,20,22)/t15-/m0/s1