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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC2=CC=C(C=C2)CC#N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC2=CC=C(C=C2)CC#N

InChI

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