[2-chloranyl-5-(trifluoromethyl)phenyl]-piperazin-4-ium-1-ylsulfonyl-azanide

Systemtic Name: [2-chloranyl-5-(trifluoromethyl)phenyl]-piperazin-4-ium-1-ylsulfonyl-azanide Openeye Name: [2-chloro-5-(trifluoromethyl)phenyl]-piperazin-4-ium-1-ylsulfonyl-azanide CAS Name: [2-chloro-5-(trifluoromethyl)phenyl]-(1-piperazin-4-iumylsulfonyl)azanide IUPAC Name: [2-chloro-5-(trifluoromethyl)phenyl]-piperazin-4-ium-1-ylsulfonylazanide Traditional Name: [2-chloro-5-(trifluoromethyl)phenyl]-piperazin-4-ium-1-ylsulfonyl-azanide Formula: C11H13ClF3N3O2S MolecularWeight: 343.75303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)S(=O)(=O)[N-]C2=C(C=CC(=C2)C(F)(F)F)Cl

Isomeric SMILES

C1CN(CC[NH2+]1)S(=O)(=O)[N-]C2=C(C=CC(=C2)C(F)(F)F)Cl

InChI

InChI=1S/C11H12ClF3N3O2S/c12-9-2-1-8(11(13,14)15)7-10(9)17-21(19,20)18-5-3-16-4-6-18/h1-2,7,16H,3-6H2/q-1/p+1