4-bromanyl-5-methyl-2-propan-2-yl-N-pyridin-1-ium-4-yl-benzenesulfonamide

Systemtic Name: 4-bromanyl-5-methyl-2-propan-2-yl-N-pyridin-1-ium-4-yl-benzenesulfonamide Openeye Name: 4-bromo-2-isopropyl-5-methyl-N-pyridin-1-ium-4-yl-benzenesulfonamide CAS Name: 4-bromo-5-methyl-2-propan-2-yl-N-(4-pyridin-1-iumyl)benzenesulfonamide IUPAC Name: 4-bromo-5-methyl-2-propan-2-yl-N-pyridin-1-ium-4-ylbenzenesulfonamide Traditional Name: 4-bromo-2-isopropyl-5-methyl-N-pyridin-1-ium-4-yl-benzenesulfonamide Formula: C15H18BrN2O2S+ MolecularWeight: 370.28462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C(C)C)S(=O)(=O)NC2=CC=[NH+]C=C2

Isomeric SMILES

CC1=CC(=C(C=C1Br)C(C)C)S(=O)(=O)NC2=CC=[NH+]C=C2

InChI

InChI=1S/C15H17BrN2O2S/c1-10(2)13-9-14(16)11(3)8-15(13)21(19,20)18-12-4-6-17-7-5-12/h4-10H,1-3H3,(H,17,18)/p+1