[3-chloranyl-4-(2-chloranylethanoylamino)phenyl] thiocyanate

Systemtic Name: [3-chloranyl-4-(2-chloranylethanoylamino)phenyl] thiocyanate Openeye Name: [3-chloro-4-[(2-chloroacetyl)amino]phenyl] thiocyanate CAS Name: thiocyanic acid [3-chloro-4-[(2-chloro-1-oxoethyl)amino]phenyl] ester IUPAC Name: [3-chloro-4-[(2-chloroacetyl)amino]phenyl] thiocyanate Traditional Name: thiocyanic acid [3-chloro-4-[(2-chloroacetyl)amino]phenyl] ester Formula: C9H6Cl2N2OS MolecularWeight: 261.12774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1SC#N)Cl)NC(=O)CCl

Isomeric SMILES

C1=CC(=C(C=C1SC#N)Cl)NC(=O)CCl

InChI

InChI=1S/C9H6Cl2N2OS/c10-4-9(14)13-8-2-1-6(15-5-12)3-7(8)11/h1-3H,4H2,(H,13,14)