2-[1-(2-bromoethyl)pyridin-1-ium-4-yl]ethanesulfonic acid

Systemtic Name: 2-[1-(2-bromoethyl)pyridin-1-ium-4-yl]ethanesulfonic acid Openeye Name: 2-[1-(2-bromoethyl)pyridin-1-ium-4-yl]ethanesulfonic acid CAS Name: 2-[1-(2-bromoethyl)-4-pyridin-1-iumyl]ethanesulfonic acid IUPAC Name: 2-[1-(2-bromoethyl)pyridin-1-ium-4-yl]ethanesulfonic acid Traditional Name: 2-[1-(2-bromoethyl)pyridin-1-ium-4-yl]ethanesulfonic acid Formula: C9H13BrNO3S+ MolecularWeight: 295.17342

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Descriptors Computed from Structure

Canonical SMILES:

C1=C[N+](=CC=C1CCS(=O)(=O)O)CCBr

Isomeric SMILES

C1=C[N+](=CC=C1CCS(=O)(=O)O)CCBr

InChI

InChI=1S/C9H12BrNO3S/c10-4-7-11-5-1-9(2-6-11)3-8-15(12,13)14/h1-2,5-6H,3-4,7-8H2/p+1