(5-azanyl-2-chloranyl-4-nitro-phenyl) thiocyanate

Systemtic Name: (5-azanyl-2-chloranyl-4-nitro-phenyl) thiocyanate Openeye Name: (5-amino-2-chloro-4-nitro-phenyl) thiocyanate CAS Name: thiocyanic acid (5-amino-2-chloro-4-nitrophenyl) ester IUPAC Name: (5-amino-2-chloro-4-nitrophenyl) thiocyanate Traditional Name: thiocyanic acid (5-amino-2-chloro-4-nitro-phenyl) ester Formula: C7H4ClN3O2S MolecularWeight: 229.64356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1SC#N)Cl)[N+](=O)[O-])N

Isomeric SMILES

C1=C(C(=CC(=C1SC#N)Cl)[N+](=O)[O-])N

InChI

InChI=1S/C7H4ClN3O2S/c8-4-1-6(11(12)13)5(10)2-7(4)14-3-9/h1-2H,10H2