Basic information
- CAS
73257-91-7- Standard SMILES
CC(=O)NC(CN1CCOCC1)C(=O)c1ccccc1.Cc1ccc(S(=O)(=O)O)cc1- InChIKey
DCQKYHLXWYICSH-UHFFFAOYSA-N- Molecular formula
- C22H28N2O6S
- Average molar mass
- 448.5 g/mol
- Monoisotopic mass
- 448.16680779
Names & identifiers
- Preferred name
- 4-methylbenzenesulfonic acid;N-(3-morpholin-4-yl-1-oxo-1-phenylpropan-2-yl)acetamide
- IUPAC
- 4-methylbenzenesulfonic acid;N-(3-morpholin-4-yl-1-oxo-1-phenylpropan-2-yl)acetamide
- English name
- 4-methylbenzenesulfonic acid, N-(3-morpholin-4-yl-1-oxo-1-phenyl-propa n-2-yl)acetamide
- Molecular formula
- C22H28N2O6S
- Molecular weight
- 0
Names & synonyms
73257-91-7NSC316127DTXSID50317473AG-G-89480NSC-3161274-Methylbenzene-1-sulfonic acid--N-[3-(morpholin-4-yl)-1-oxo-1-phenylpropan-2-yl]acetamide (1/1)4-methylbenzenesulfonic acid, N-(3-morpholin-4-yl-1-oxo-1-phenyl-propa n-2-yl)acetamide
Database identifiers
- CAS
73257-91-7- PubChem CID
- 330123
- DTXSID
DTXSID50317473
Properties
Computed structural properties
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 540
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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