Basic information
- Standard SMILES
CS(=O)(=O)Nc1cc2occ(Cl)c(=O)c2cc1Oc1ccccc1- InChIKey
OCBHLVKLPAYNCF-UHFFFAOYSA-N- Molecular formula
- C16H12ClNO5S
- Average molar mass
- 365.8 g/mol
Names & identifiers
- Preferred name
- 3-chloro-7-methylsulfonylamino-6-phenoxy-4H-1-benzopyran-4-one
- IUPAC
- N-(3-chloro-4-oxo-6-phenoxychromen-7-yl)methanesulfonamide
Names & synonyms
SCHEMBL10415417OCBHLVKLPAYNCF-UHFFFAOYSA-N3-chloro-7-methylsulfonylamino-6-phenoxy-4H-1-benzopyran-4-one
Database identifiers
- PubChem CID
- 14722384
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 90.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 608
Related reactions
2 records
Compound notes
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