Basic information
- Standard SMILES
CCOC(=O)C1CCNC1c1cc(NC(=O)OC)ccc1S(=O)(=O)C1CC1- InChIKey
URRUHLDASBGBHC-UHFFFAOYSA-N- Molecular formula
- C18H24N2O6S
- Average molar mass
- 396.5 g/mol
- Monoisotopic mass
- 396.13550766
Names & identifiers
- IUPAC
- ethyl 2-[2-cyclopropylsulfonyl-5-(methoxycarbonylamino)phenyl]pyrrolidine-3-carboxylate
Database identifiers
- PubChem CID
- 72303928
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 657
Related reactions
1 records
Compound notes
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