2-[[4-[(2-chloranyl-4-nitro-phenyl)diazenyl]phenyl]-(1-cyanoethyl)amino]propanenitrile

Systemtic Name: 2-[[4-[(2-chloranyl-4-nitro-phenyl)diazenyl]phenyl]-(1-cyanoethyl)amino]propanenitrile Openeye Name: 2-[4-(2-chloro-4-nitro-phenyl)azo-N-(1-cyanoethyl)anilino]propanenitrile CAS Name: 2-[4-(2-chloro-4-nitrophenyl)azo-N-(1-cyanoethyl)anilino]propanenitrile IUPAC Name: 2-[4-[(2-chloro-4-nitrophenyl)diazenyl]-N-(1-cyanoethyl)anilino]propanenitrile Traditional Name: 2-[4-(2-chloro-4-nitro-phenyl)azo-N-(1-cyanoethyl)anilino]propionitrile Formula: C18H15ClN6O2 MolecularWeight: 382.8037

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)N(C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(C)C#N

Isomeric SMILES

CC(C#N)N(C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(C)C#N

InChI

InChI=1S/C18H15ClN6O2/c1-12(10-20)24(13(2)11-21)15-5-3-14(4-6-15)22-23-18-8-7-16(25(26)27)9-17(18)19/h3-9,12-13H,1-2H3