(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethylcarbamic acid

Systemtic Name: (1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethylcarbamic acid Openeye Name: (1-oxidopyridin-1-ium-2-yl)sulfanylmethylcarbamic acid CAS Name: [(1-oxido-2-pyridin-1-iumyl)thio]methylcarbamic acid IUPAC Name: (1-oxidopyridin-1-ium-2-yl)sulfanylmethylcarbamic acid Traditional Name: [(1-oxidopyridin-1-ium-2-yl)thio]methylcarbamic acid Formula: C7H8N2O3S MolecularWeight: 200.21502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)SCNC(=O)O)[O-]

Isomeric SMILES

C1=CC=[N+](C(=C1)SCNC(=O)O)[O-]

InChI

InChI=1S/C7H8N2O3S/c10-7(11)8-5-13-6-3-1-2-4-9(6)12/h1-4,8H,5H2,(H,10,11)