Basic information
- Standard SMILES
CCCCS(=O)(=O)NC(=O)c1ccc([N+](=O)[O-])c(N)c1- InChIKey
FXFLESINPHHSEM-UHFFFAOYSA-N- Molecular formula
- C11H15N3O5S
- Average molar mass
- 301.32 g/mol
Names & identifiers
- Preferred name
- N-1-butanesulfonyl-3-amino-4-nitrobenzamide
- IUPAC
- 3-amino-N-butylsulfonyl-4-nitrobenzamide
Names & synonyms
SCHEMBL6171135FXFLESINPHHSEM-UHFFFAOYSA-NN-1-butanesulfonyl-3-amino-4-nitrobenzamide
Database identifiers
- PubChem CID
- 18315533
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 143 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 454
Related reactions
6 records
Compound notes
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