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4-[2-(4-bromophenyl)sulfanylethyl]pyridin-1-ium; dihydrogen phosphate
4-[2-(4-bromophenyl)sulfanylethyl]pyridin-1-ium; dihydrogen phosphate
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC(=CC=C1SCCC2=CC=[NH+]C=C2)Br.OP(=O)(O)[O-]
Isomeric SMILES
C1=CC(=CC=C1SCCC2=CC=[NH+]C=C2)Br.OP(=O)(O)[O-]
InChI
InChI=1S/C13H12BrNS.H3O4P/c14-12-1-3-13(4-2-12)16-10-7-11-5-8-15-9-6-11;1-5(2,3)4/h1-6,8-9H,7,10H2;(H3,1,2,3,4)
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