4-bromanyl-2-chloranyl-N-(3-piperidin-1-ium-1-ylpropyl)benzenesulfonamide

Systemtic Name: 4-bromanyl-2-chloranyl-N-(3-piperidin-1-ium-1-ylpropyl)benzenesulfonamide Openeye Name: 4-bromo-2-chloro-N-(3-piperidin-1-ium-1-ylpropyl)benzenesulfonamide CAS Name: 4-bromo-2-chloro-N-[3-(1-piperidin-1-iumyl)propyl]benzenesulfonamide IUPAC Name: 4-bromo-2-chloro-N-(3-piperidin-1-ium-1-ylpropyl)benzenesulfonamide Traditional Name: 4-bromo-2-chloro-N-(3-piperidin-1-ium-1-ylpropyl)benzenesulfonamide Formula: C14H21BrClN2O2S+ MolecularWeight: 396.75074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCNS(=O)(=O)C2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

C1CC[NH+](CC1)CCCNS(=O)(=O)C2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C14H20BrClN2O2S/c15-12-5-6-14(13(16)11-12)21(19,20)17-7-4-10-18-8-2-1-3-9-18/h5-6,11,17H,1-4,7-10H2/p+1