[(2S)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 2-(2,4,6-trimethylphenoxy)ethanoate

Systemtic Name: [(2S)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 2-(2,4,6-trimethylphenoxy)ethanoate Openeye Name: [(1S)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] 2-(2,4,6-trimethylphenoxy)acetate CAS Name: 2-(2,4,6-trimethylphenoxy)acetic acid [(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl] 2-(2,4,6-trimethylphenoxy)acetate Traditional Name: 2-(2,4,6-trimethylphenoxy)acetic acid [(1S)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H23NO4 MolecularWeight: 305.36882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OCC(=O)OC(C)C(=O)NC2CC2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OCC(=O)O[C@@H](C)C(=O)NC2CC2)C

InChI

InChI=1S/C17H23NO4/c1-10-7-11(2)16(12(3)8-10)21-9-15(19)22-13(4)17(20)18-14-5-6-14/h7-8,13-14H,5-6,9H2,1-4H3,(H,18,20)/t13-/m0/s1