2-(2-chloranyl-4-nitro-phenoxy)-N-[2-(cyanomethylsulfanyl)phenyl]ethanamide

Systemtic Name: 2-(2-chloranyl-4-nitro-phenoxy)-N-[2-(cyanomethylsulfanyl)phenyl]ethanamide Openeye Name: 2-(2-chloro-4-nitro-phenoxy)-N-[2-(cyanomethylsulfanyl)phenyl]acetamide CAS Name: 2-(2-chloro-4-nitrophenoxy)-N-[2-(cyanomethylthio)phenyl]acetamide IUPAC Name: 2-(2-chloro-4-nitrophenoxy)-N-[2-(cyanomethylsulfanyl)phenyl]acetamide Traditional Name: 2-(2-chloro-4-nitro-phenoxy)-N-[2-(cyanomethylthio)phenyl]acetamide Formula: C16H12ClN3O4S MolecularWeight: 377.80218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl)SCC#N

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl)SCC#N

InChI

InChI=1S/C16H12ClN3O4S/c17-12-9-11(20(22)23)5-6-14(12)24-10-16(21)19-13-3-1-2-4-15(13)25-8-7-18/h1-6,9H,8,10H2,(H,19,21)