Basic information
- Standard SMILES
CCON=C(CC)C1=C(O)CC(c2c(C)cc(C)c(S(=O)(=O)N(C)C)c2C)CC1=O- InChIKey
UYPJVSVTXJCWJL-UHFFFAOYSA-N- Molecular formula
- C22H32N2O5S
- Average molar mass
- 436.6 g/mol
Names & identifiers
- Preferred name
- 2-[1-(Ethoxyimino)propyl]-3-hydroxy-5-(2,4,6-trimethyl-3-dimethylsulfamoylphenyl)cyclohex-2-en-1-one
- IUPAC
- 3-[4-(N-ethoxy-C-ethylcarbonimidoyl)-3-hydroxy-5-oxocyclohex-3-en-1-yl]-N,N,2,4,6-pentamethylbenzenesulfonamide
Names & synonyms
SCHEMBL10682593UYPJVSVTXJCWJL-UHFFFAOYSA-N2-[1-(Ethoxyimino)propyl]-3-hydroxy-5-(2,4,6-trimethyl-3-dimethylsulfamoylphenyl)cyclohex-2-en-1-one
Database identifiers
- PubChem CID
- 136199545
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 797
Related reactions
2 records
Linked notes
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