[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] (2S)-2-(4-cyanophenoxy)propanoate

Systemtic Name: [(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] (2S)-2-(4-cyanophenoxy)propanoate Openeye Name: [(1R)-2-amino-1-methyl-2-oxo-ethyl] (2S)-2-(4-cyanophenoxy)propanoate CAS Name: (2S)-2-(4-cyanophenoxy)propanoic acid [(2R)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-amino-1-oxopropan-2-yl] (2S)-2-(4-cyanophenoxy)propanoate Traditional Name: (2S)-2-(4-cyanophenoxy)propionic acid [(1R)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C(C)OC1=CC=C(C=C1)C#N

Isomeric SMILES

C[C@H](C(=O)N)OC(=O)[C@H](C)OC1=CC=C(C=C1)C#N

InChI

InChI=1S/C13H14N2O4/c1-8(12(15)16)19-13(17)9(2)18-11-5-3-10(7-14)4-6-11/h3-6,8-9H,1-2H3,(H2,15,16)/t8-,9+/m1/s1