Basic information
- Standard SMILES
CC(C(=O)O)N1CCC(NS(=O)(=O)c2ccc3cc(Cl)ccc3c2)C1=O- InChIKey
NOAVDWOUDADYBW-UHFFFAOYSA-N- Molecular formula
- C17H17ClN2O5S
- Average molar mass
- 396.8 g/mol
Names & identifiers
- Preferred name
- 2-[3-[(6-Chloronaphthalen-2-yl)sulfonylamino]-2-oxopyrrolidin-1-yl]propanoic acid
- IUPAC
- 2-[3-[(6-chloronaphthalen-2-yl)sulfonylamino]-2-oxopyrrolidin-1-yl]propanoic acid
Names & synonyms
SCHEMBL4891999
Database identifiers
- PubChem CID
- 22016980
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 665
Related reactions
8 records
Compound notes
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