Basic information
- CAS
37126-72-0- Standard SMILES
CCC1(c2ccccc2)C[NH+](CCC[NH+]2CCCCC2)c2ccccc21.[Cl-].[Cl-]- InChIKey
GWHRYDUZMQZXID-UHFFFAOYSA-N- Molecular formula
- C24H34Cl2N2
- Average molar mass
- 421.4 g/mol
- Monoisotopic mass
- 420.2099045
Names & identifiers
- Preferred name
- 1H-Indole, 2,3-dihydro-3-ethyl-3-phenyl-1-(3-piperidinopropyl)-, dihydrochloride
- IUPAC
- 3-ethyl-3-phenyl-1-(3-piperidin-1-ium-1-ylpropyl)-1,2-dihydroindol-1-ium dichloride
Names & synonyms
2,3-Dihydro-3-ethyl-3-phenyl-1-(3-piperidinopropyl)-1H-indole dihydrochloride37126-72-01H-INDOLE, 2,3-DIHYDRO-3-ETHYL-3-PHENYL-1-(3-PIPERIDINOPROPYL)-, DIHYDROCHLORIDERefChem:238713
Database identifiers
- CAS
37126-72-0- PubChem CID
- 37675
Properties
Computed structural properties
- Topological polar surface area
- 8.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 424
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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