2-bromanylethanesulfonate; pyridin-1-ium

Systemtic Name: 2-bromanylethanesulfonate; pyridin-1-ium Openeye Name: 2-bromoethanesulfonate; pyridin-1-ium CAS Name: 2-bromoethanesulfonate; pyridin-1-ium IUPAC Name: 2-bromoethanesulfonate; pyridin-1-ium Traditional Name: 2-bromoethanesulfonate; pyridin-1-ium Formula: C7H10BrNO3S MolecularWeight: 268.1282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[NH+]C=C1.C(CBr)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=[NH+]C=C1.C(CBr)S(=O)(=O)[O-]

InChI

InChI=1S/C5H5N.C2H5BrO3S/c1-2-4-6-5-3-1;3-1-2-7(4,5)6/h1-5H;1-2H2,(H,4,5,6)