cyanomethyl (2S)-2-(phenylcarbamoylamino)propanoate

Systemtic Name: cyanomethyl (2S)-2-(phenylcarbamoylamino)propanoate Openeye Name: cyanomethyl (2S)-2-(phenylcarbamoylamino)propanoate CAS Name: (2S)-2-[[anilino(oxo)methyl]amino]propanoic acid cyanomethyl ester IUPAC Name: cyanomethyl (2S)-2-(phenylcarbamoylamino)propanoate Traditional Name: (2S)-2-(phenylcarbamoylamino)propionic acid cyanomethyl ester Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC#N)NC(=O)NC1=CC=CC=C1

Isomeric SMILES

C[C@@H](C(=O)OCC#N)NC(=O)NC1=CC=CC=C1

InChI

InChI=1S/C12H13N3O3/c1-9(11(16)18-8-7-13)14-12(17)15-10-5-3-2-4-6-10/h2-6,9H,8H2,1H3,(H2,14,15,17)/t9-/m0/s1