methyl (2S)-2-[[3-(cyanomethoxy)phenyl]methylamino]propanoate

Systemtic Name: methyl (2S)-2-[[3-(cyanomethoxy)phenyl]methylamino]propanoate Openeye Name: methyl (2S)-2-[[3-(cyanomethoxy)phenyl]methylamino]propanoate CAS Name: (2S)-2-[[3-(cyanomethoxy)phenyl]methylamino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[3-(cyanomethoxy)phenyl]methylamino]propanoate Traditional Name: (2S)-2-[[3-(cyanomethoxy)benzyl]amino]propionic acid methyl ester Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NCC1=CC(=CC=C1)OCC#N

Isomeric SMILES

C[C@@H](C(=O)OC)NCC1=CC(=CC=C1)OCC#N

InChI

InChI=1S/C13H16N2O3/c1-10(13(16)17-2)15-9-11-4-3-5-12(8-11)18-7-6-14/h3-5,8,10,15H,7,9H2,1-2H3/t10-/m0/s1