Basic information
- Standard SMILES
COC(=O)[C@@H]1C[C@@H](OS(=O)(=O)c2ccc(C)cc2)CN1C(=O)OCc1ccccc1- InChIKey
CRGZVZQOSILHGM-MJGOQNOKSA-N- Molecular formula
- C21H23NO7S
- Average molar mass
- 433.5 g/mol
Names & identifiers
- Preferred name
- Zofenopril Impurity 4
- IUPAC
- 1-O-benzyl 2-O-methyl (2S,4R)-4-(4-methylphenyl)sulfonyloxypyrrolidine-1,2-dicarboxylate
Names & synonyms
57653-38-0NSC690773Zofenopril Impurity 4SCHEMBL5764432CRGZVZQOSILHGM-MJGOQNOKSA-N1-Benzyl 2-methyl (2S,4R)-4-(tosyloxy)pyrrolidine-1,2-dicarboxylateNSC-690773N-carbobenzyloxy-trans-4-tosyloxy-L-proline, methyl ester(2S,4R)-1-benzyloxycarbonyl-4-(p-toluenesulfonyloxy)proline methyl ester1-[(phenylmethoxy)carbonyl]-trans-4-tosyloxy-L-proline, methyl ester
Database identifiers
- PubChem CID
- 391525
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 691
Related reactions
6 records
Compound notes
Loading…