1-cyanoethyl 2-[(2-methylphenyl)carbonylamino]ethanoate

Systemtic Name: 1-cyanoethyl 2-[(2-methylphenyl)carbonylamino]ethanoate Openeye Name: 1-cyanoethyl 2-[(2-methylbenzoyl)amino]acetate CAS Name: 2-[[(2-methylphenyl)-oxomethyl]amino]acetic acid 1-cyanoethyl ester IUPAC Name: 1-cyanoethyl 2-[(2-methylbenzoyl)amino]acetate Traditional Name: 2-(o-toluoylamino)acetic acid 1-cyanoethyl ester Formula: C13H14N2O3 MolecularWeight: 246.26186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCC(=O)OC(C)C#N

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCC(=O)OC(C)C#N

InChI

InChI=1S/C13H14N2O3/c1-9-5-3-4-6-11(9)13(17)15-8-12(16)18-10(2)7-14/h3-6,10H,8H2,1-2H3,(H,15,17)