Basic information
- CAS
40714-59-8- Standard SMILES
CC[NH+](CC)CCC1(c2ccccc2)C(=O)N(N2CCCCC2)c2ccccc21.[Cl-]- InChIKey
YMLUOHSTGNQSKL-UHFFFAOYSA-N- Molecular formula
- C25H34ClN3O
- Average molar mass
- 428 g/mol
- Monoisotopic mass
- 427.2390404
Names & identifiers
- Preferred name
- 2-Indolinone, 3-(2-(diethylamino)ethyl)-3-phenyl-1-piperidino-, monohydrochloride
- IUPAC
- diethyl-[2-(2-oxo-3-phenyl-1-piperidin-1-ylindol-3-yl)ethyl]azanium chloride
Names & synonyms
3-(2-(Diethylamino)ethyl)-3-phenyl-1-piperidino-2-indolinone hydrochloride40714-59-82-Indolinone, 3-(2-(diethylamino)ethyl)-3-phenyl-1-piperidino-, monohydrochlorideRefChem:262097
Database identifiers
- CAS
40714-59-8- PubChem CID
- 38644
Properties
Computed structural properties
- Topological polar surface area
- 28 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 536
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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