3-[[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)amino]propanenitrile

Systemtic Name: 3-[[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)amino]propanenitrile Openeye Name: 3-[[2-(4-bromophenyl)-2-oxo-ethyl]-(2-furylmethyl)amino]propanenitrile CAS Name: 3-[[2-(4-bromophenyl)-2-oxoethyl]-(2-furanylmethyl)amino]propanenitrile IUPAC Name: 3-[[2-(4-bromophenyl)-2-oxoethyl]-(furan-2-ylmethyl)amino]propanenitrile Traditional Name: 3-[[2-(4-bromophenyl)-2-keto-ethyl]-(2-furfuryl)amino]propionitrile Formula: C16H15BrN2O2 MolecularWeight: 347.2065

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN(CCC#N)CC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C1=COC(=C1)CN(CCC#N)CC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H15BrN2O2/c17-14-6-4-13(5-7-14)16(20)12-19(9-2-8-18)11-15-3-1-10-21-15/h1,3-7,10H,2,9,11-12H2