2-[2-cyanoethyl-(4-methoxyphenyl)amino]ethanoate

Systemtic Name: 2-[2-cyanoethyl-(4-methoxyphenyl)amino]ethanoate Openeye Name: 2-[N-(2-cyanoethyl)-4-methoxy-anilino]acetate CAS Name: 2-[N-(2-cyanoethyl)-4-methoxyanilino]acetate IUPAC Name: 2-[N-(2-cyanoethyl)-4-methoxyanilino]acetate Traditional Name: 2-[N-(2-cyanoethyl)-4-methoxy-anilino]acetate Formula: C12H13N2O3- MolecularWeight: 233.24322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CCC#N)CC(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N(CCC#N)CC(=O)[O-]

InChI

InChI=1S/C12H14N2O3/c1-17-11-5-3-10(4-6-11)14(8-2-7-13)9-12(15)16/h3-6H,2,8-9H2,1H3,(H,15,16)/p-1