methyl 5-[[[4-(cyanomethyl)phenyl]amino]methyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[[[4-(cyanomethyl)phenyl]amino]methyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[[4-(cyanomethyl)anilino]methyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[4-(cyanomethyl)anilino]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-(cyanomethyl)anilino]methyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[[4-(cyanomethyl)anilino]methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C16H16N2O3 MolecularWeight: 284.30984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CNC2=CC=C(C=C2)CC#N)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CNC2=CC=C(C=C2)CC#N)C(=O)OC

InChI

InChI=1S/C16H16N2O3/c1-11-15(16(19)20-2)9-14(21-11)10-18-13-5-3-12(4-6-13)7-8-17/h3-6,9,18H,7,10H2,1-2H3