Basic information
- CAS
37126-55-9- Standard SMILES
CCC1(c2ccccc2)C(=O)N(CCC[NH+](C)C)c2ccccc21.[Cl-]- InChIKey
XPHCYFLGLROFHF-UHFFFAOYSA-N- Molecular formula
- C21H27ClN2O
- Average molar mass
- 358.9 g/mol
- Monoisotopic mass
- 358.1811912
Names & identifiers
- Preferred name
- 2H-Indol-2-one, 1,3-dihydro-1-(3-(dimethylamino)propyl)-3-ethyl-3-phenyl-, monohydrochloride
- IUPAC
- 3-(3-ethyl-2-oxo-3-phenylindol-1-yl)propyl-dimethylazanium chloride
Names & synonyms
37126-55-91,3-Dihydro-1-(3-(dimethylamino)propyl)-3-ethyl-3-phenyl-2H-indol-2-one hydrochloride2H-Indol-2-one, 1,3-dihydro-1-(3-(dimethylamino)propyl)-3-ethyl-3-phenyl-, monohydrochlorideRefChem:268692
Database identifiers
- CAS
37126-55-9- PubChem CID
- 37643
Properties
Computed structural properties
- Topological polar surface area
- 24.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 430
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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