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

Systemtic Name: 4-[2-cyanoethyl(phenyl)amino]butanoate Openeye Name: 4-[N-(2-cyanoethyl)anilino]butanoate CAS Name: 4-[N-(2-cyanoethyl)anilino]butanoate IUPAC Name: 4-[N-(2-cyanoethyl)anilino]butanoate Traditional Name: 4-[N-(2-cyanoethyl)anilino]butyrate Formula: C13H15N2O2- MolecularWeight: 231.2704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O2/c14-9-5-11-15(10-4-8-13(16)17)12-6-2-1-3-7-12/h1-3,6-7H,4-5,8,10-11H2,(H,16,17)/p-1