Basic information
- CAS
63917-68-0- Standard SMILES
O=C1Oc2ccccc2C1(CCC[NH+]1CCOCC1)c1ccccc1.[Cl-]- InChIKey
QKRZVQSVSZJPJP-UHFFFAOYSA-N- Molecular formula
- C21H24ClNO3
- Average molar mass
- 373.9 g/mol
- Monoisotopic mass
- 373.1444713
Names & identifiers
- Preferred name
- 2(3H)-Benzofuranone, 3-(3-morpholinopropyl)-3-phenyl-, hydrochloride
- IUPAC
- 3-(3-morpholin-4-ium-4-ylpropyl)-3-phenyl-1-benzofuran-2-one chloride
Names & synonyms
AP 582(3H)-BENZOFURANONE, 3-(3-MORPHOLINOPROPYL)-3-PHENYL-, HYDROCHLORIDE63917-68-0RefChem:241474
Database identifiers
- CAS
63917-68-0- PubChem CID
- 45309
Properties
Computed structural properties
- Topological polar surface area
- 40 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 456
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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