Basic information
- Standard SMILES
O=C(NS(=O)(=O)c1ccccc1)c1ccc(C(=O)[O-])nc1- InChIKey
VXCNNKUETLEVAO-UHFFFAOYSA-M- Molecular formula
- C13H9N2O5S-
- Average molar mass
- 305.29 g/mol
Names & identifiers
- Preferred name
- 5-[((Phenylsulfonyl)amino)carbonyl]-pyridine-2-carboxylate
- IUPAC
- 5-(benzenesulfonylcarbamoyl)pyridine-2-carboxylate
Names & synonyms
VXCNNKUETLEVAO-UHFFFAOYSA-M5-[((phenylsulfonyl)amino)carbonyl]-pyridine-2-carboxylate
Database identifiers
- PubChem CID
- 19928173
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- -1
- Complexity
- 488
Related reactions
1 records
Compound notes
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