(Z)-4-[(2-chlorophenyl)-(2-cyanoethyl)amino]but-2-enenitrile

Systemtic Name: (Z)-4-[(2-chlorophenyl)-(2-cyanoethyl)amino]but-2-enenitrile Openeye Name: (Z)-4-[2-chloro-N-(2-cyanoethyl)anilino]but-2-enenitrile CAS Name: (Z)-4-[2-chloro-N-(2-cyanoethyl)anilino]-2-butenenitrile IUPAC Name: (Z)-4-[2-chloro-N-(2-cyanoethyl)anilino]but-2-enenitrile Traditional Name: (Z)-4-[2-chloro-N-(2-cyanoethyl)anilino]but-2-enenitrile Formula: C13H12ClN3 MolecularWeight: 245.70748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N(CCC#N)CC=CC#N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)N(CCC#N)C/C=C\C#N)Cl

InChI

InChI=1S/C13H12ClN3/c14-12-6-1-2-7-13(12)17(11-5-9-16)10-4-3-8-15/h1-4,6-7H,5,10-11H2/b4-3-