cyanomethyl 2-[(4-methylphenyl)carbonylamino]ethanoate

Systemtic Name: cyanomethyl 2-[(4-methylphenyl)carbonylamino]ethanoate Openeye Name: cyanomethyl 2-[(4-methylbenzoyl)amino]acetate CAS Name: 2-[[(4-methylphenyl)-oxomethyl]amino]acetic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-[(4-methylbenzoyl)amino]acetate Traditional Name: 2-(p-toluoylamino)acetic acid cyanomethyl ester Formula: C12H12N2O3 MolecularWeight: 232.23528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCC(=O)OCC#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NCC(=O)OCC#N

InChI

InChI=1S/C12H12N2O3/c1-9-2-4-10(5-3-9)12(16)14-8-11(15)17-7-6-13/h2-5H,7-8H2,1H3,(H,14,16)