[1-[3-(bromomethyl)phenyl]-1-ethylsulfonyl-2H-pyridin-1-ium-5-yl]methanamine

Systemtic Name: [1-[3-(bromomethyl)phenyl]-1-ethylsulfonyl-2H-pyridin-1-ium-5-yl]methanamine Openeye Name: [1-[3-(bromomethyl)phenyl]-1-ethylsulfonyl-2H-pyridin-1-ium-5-yl]methanamine CAS Name: [1-[3-(bromomethyl)phenyl]-1-ethylsulfonyl-2H-pyridin-1-ium-5-yl]methanamine IUPAC Name: [1-[3-(bromomethyl)phenyl]-1-ethylsulfonyl-2H-pyridin-1-ium-5-yl]methanamine Traditional Name: [1-[3-(bromomethyl)phenyl]-1-esyl-2H-pyridin-1-ium-5-yl]methylamine Formula: C15H20BrN2O2S+ MolecularWeight: 372.3005

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)[N+]1(CC=CC(=C1)CN)C2=CC=CC(=C2)CBr

Isomeric SMILES

CCS(=O)(=O)[N+]1(CC=CC(=C1)CN)C2=CC=CC(=C2)CBr

InChI

InChI=1S/C15H20BrN2O2S/c1-2-21(19,20)18(8-4-6-14(11-17)12-18)15-7-3-5-13(9-15)10-16/h3-7,9,12H,2,8,10-11,17H2,1H3/q+1