(phenylmethyl) 2-(1-cyanoethylamino)ethanoate

Systemtic Name: (phenylmethyl) 2-(1-cyanoethylamino)ethanoate Openeye Name: benzyl 2-(1-cyanoethylamino)acetate CAS Name: 2-(1-cyanoethylamino)acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(1-cyanoethylamino)acetate Traditional Name: 2-(1-cyanoethylamino)acetic acid benzyl ester Formula: C12H14N2O2 MolecularWeight: 218.25176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)NCC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C#N)NCC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C12H14N2O2/c1-10(7-13)14-8-12(15)16-9-11-5-3-2-4-6-11/h2-6,10,14H,8-9H2,1H3