2-[2-cyanoethyl(phenyl)amino]ethyl benzoate

Systemtic Name: 2-[2-cyanoethyl(phenyl)amino]ethyl benzoate Openeye Name: 2-[N-(2-cyanoethyl)anilino]ethyl benzoate CAS Name: benzoic acid 2-[N-(2-cyanoethyl)anilino]ethyl ester IUPAC Name: 2-[N-(2-cyanoethyl)anilino]ethyl benzoate Traditional Name: benzoic acid 2-[N-(2-cyanoethyl)anilino]ethyl ester Formula: C18H18N2O2 MolecularWeight: 294.34772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCN(CCC#N)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCN(CCC#N)C2=CC=CC=C2

InChI

InChI=1S/C18H18N2O2/c19-12-7-13-20(17-10-5-2-6-11-17)14-15-22-18(21)16-8-3-1-4-9-16/h1-6,8-11H,7,13-15H2