methyl 4-[2-cyanoethyl(phenyl)amino]butanoate

Systemtic Name: methyl 4-[2-cyanoethyl(phenyl)amino]butanoate Openeye Name: methyl 4-[N-(2-cyanoethyl)anilino]butanoate CAS Name: 4-[N-(2-cyanoethyl)anilino]butanoic acid methyl ester IUPAC Name: methyl 4-[N-(2-cyanoethyl)anilino]butanoate Traditional Name: 4-[N-(2-cyanoethyl)anilino]butyric acid methyl ester Formula: C14H18N2O2 MolecularWeight: 246.30492

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O2/c1-18-14(17)9-5-11-16(12-6-10-15)13-7-3-2-4-8-13/h2-4,7-8H,5-6,9,11-12H2,1H3