[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] (3R)-3-acetamido-3-phenyl-propanoate

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] (3R)-3-acetamido-3-phenyl-propanoate Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl] (3R)-3-acetamido-3-phenyl-propanoate CAS Name: (3R)-3-acetamido-3-phenylpropanoic acid [(2S)-1-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] (3R)-3-acetamido-3-phenylpropanoate Traditional Name: (3R)-3-acetamido-3-phenyl-propionic acid [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H22N2O4 MolecularWeight: 306.35688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)C

Isomeric SMILES

CCNC(=O)[C@H](C)OC(=O)C[C@H](C1=CC=CC=C1)NC(=O)C

InChI

InChI=1S/C16H22N2O4/c1-4-17-16(21)11(2)22-15(20)10-14(18-12(3)19)13-8-6-5-7-9-13/h5-9,11,14H,4,10H2,1-3H3,(H,17,21)(H,18,19)/t11-,14+/m0/s1