Basic information
- Standard SMILES
Cl.NC1=NS(=O)(=O)Nc2cccc(OC[C@H]3CCC[NH2+]C3)c21- InChIKey
NKRNRFJHAQLTCL-FVGYRXGTSA-O- Molecular formula
- C13H20ClN4O3S+
- Average molar mass
- 347.84 g/mol
Names & identifiers
- Preferred name
- (S)-3-(((4-amino-2,2-dioxido-1H-benzo[c][1,2,6]thiadiazin-5-yl)oxy)methyl)piperidinium hydrochloride
- IUPAC
- 2,2-dioxo-5-[[(3S)-piperidin-1-ium-3-yl]methoxy]-1H-2λ6,1,3-benzothiadiazin-4-amine;hydrochloride
Names & synonyms
NKRNRFJHAQLTCL-FVGYRXGTSA-O(S)-3-(((4-amino-2,2-dioxido-1H-benzo[c][1,2,6]thiadiazin-5-yl)oxy)methyl)piperidinium hydrochloride
Database identifiers
- PubChem CID
- 86714280
Properties
Computed structural properties
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 1
- Complexity
- 502
Related reactions
9 records
Compound notes
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