methyl 2-[[[4-(cyanomethyl)phenyl]amino]methyl]benzoate

Systemtic Name: methyl 2-[[[4-(cyanomethyl)phenyl]amino]methyl]benzoate Openeye Name: methyl 2-[[4-(cyanomethyl)anilino]methyl]benzoate CAS Name: 2-[[4-(cyanomethyl)anilino]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-(cyanomethyl)anilino]methyl]benzoate Traditional Name: 2-[[4-(cyanomethyl)anilino]methyl]benzoic acid methyl ester Formula: C17H16N2O2 MolecularWeight: 280.32114

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1CNC2=CC=C(C=C2)CC#N

Isomeric SMILES

COC(=O)C1=CC=CC=C1CNC2=CC=C(C=C2)CC#N

InChI

InChI=1S/C17H16N2O2/c1-21-17(20)16-5-3-2-4-14(16)12-19-15-8-6-13(7-9-15)10-11-18/h2-9,19H,10,12H2,1H3