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[1-[[4-(bromomethyl)phenyl]methyl]pyridin-1-ium-3-yl]methylsulfamic acid
[1-[[4-(bromomethyl)phenyl]methyl]pyridin-1-ium-3-yl]methylsulfamic acid
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC(=C[N+](=C1)CC2=CC=C(C=C2)CBr)CNS(=O)(=O)O
Isomeric SMILES
C1=CC(=C[N+](=C1)CC2=CC=C(C=C2)CBr)CNS(=O)(=O)O
InChI
InChI=1S/C14H15BrN2O3S/c15-8-12-3-5-13(6-4-12)10-17-7-1-2-14(11-17)9-16-21(18,19)20/h1-7,11,16H,8-10H2/p+1
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