4-bromanyl-N-[(1-ethylpiperidin-1-ium-4-ylidene)amino]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[(1-ethylpiperidin-1-ium-4-ylidene)amino]benzenesulfonamide Openeye Name: 4-bromo-N-[(1-ethylpiperidin-1-ium-4-ylidene)amino]benzenesulfonamide CAS Name: 4-bromo-N-[(1-ethyl-4-piperidin-1-iumylidene)amino]benzenesulfonamide IUPAC Name: 4-bromo-N-[(1-ethylpiperidin-1-ium-4-ylidene)amino]benzenesulfonamide Traditional Name: 4-bromo-N-[(1-ethylpiperidin-1-ium-4-ylidene)amino]benzenesulfonamide Formula: C13H19BrN3O2S+ MolecularWeight: 361.27786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(=NNS(=O)(=O)C2=CC=C(C=C2)Br)CC1

Isomeric SMILES

CC[NH+]1CCC(=NNS(=O)(=O)C2=CC=C(C=C2)Br)CC1

InChI

InChI=1S/C13H18BrN3O2S/c1-2-17-9-7-12(8-10-17)15-16-20(18,19)13-5-3-11(14)4-6-13/h3-6,16H,2,7-10H2,1H3/p+1