methyl 2-[2-cyanoethyl(phenyl)amino]ethanoate

Systemtic Name: methyl 2-[2-cyanoethyl(phenyl)amino]ethanoate Openeye Name: methyl 2-[N-(2-cyanoethyl)anilino]acetate CAS Name: 2-[N-(2-cyanoethyl)anilino]acetic acid methyl ester IUPAC Name: methyl 2-[N-(2-cyanoethyl)anilino]acetate Traditional Name: 2-[N-(2-cyanoethyl)anilino]acetic acid methyl ester Formula: C12H14N2O2 MolecularWeight: 218.25176

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN(CCC#N)C1=CC=CC=C1

Isomeric SMILES

COC(=O)CN(CCC#N)C1=CC=CC=C1

InChI

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