methyl 3-[2-cyanoethyl-(3-methylphenyl)amino]propanoate

Systemtic Name: methyl 3-[2-cyanoethyl-(3-methylphenyl)amino]propanoate Openeye Name: methyl 3-[N-(2-cyanoethyl)-3-methyl-anilino]propanoate CAS Name: 3-[N-(2-cyanoethyl)-3-methylanilino]propanoic acid methyl ester IUPAC Name: methyl 3-[N-(2-cyanoethyl)-3-methylanilino]propanoate Traditional Name: 3-[N-(2-cyanoethyl)-3-methyl-anilino]propionic acid methyl ester Formula: C14H18N2O2 MolecularWeight: 246.30492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CCC#N)CCC(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)N(CCC#N)CCC(=O)OC

InChI

InChI=1S/C14H18N2O2/c1-12-5-3-6-13(11-12)16(9-4-8-15)10-7-14(17)18-2/h3,5-6,11H,4,7,9-10H2,1-2H3