2-Propanol, 1-((1,1-dimethylethyl)amino)-3-(2-(1-(1H-indol-4-yl)ethenyl)phenoxy)-, monohydrochloride, (+-)-
Basic information
- CAS
133994-77-1- Standard SMILES
C=C(c1ccccc1OCC(O)CNC(C)(C)C)c1cccc2[nH]ccc12.Cl- InChIKey
MHDZFFQTBGZNHW-UHFFFAOYSA-N- Molecular formula
- C23H29ClN2O2
- Average molar mass
- 400.9 g/mol
- Monoisotopic mass
- 400.1917559
Names & identifiers
- Preferred name
- 2-Propanol, 1-((1,1-dimethylethyl)amino)-3-(2-(1-(1H-indol-4-yl)ethenyl)phenoxy)-, monohydrochloride, (+-)-
- IUPAC
- 1-(tert-butylamino)-3-[2-[1-(1H-indol-4-yl)ethenyl]phenoxy]propan-2-ol;hydrochloride
Names & synonyms
(+-)-3-((1,1-Dimethylethyl)amino)-(2-(1-(1H-indol-4-yl)ethenyl)phenoxy)-2-propanol HCl133994-77-12-Propanol, 1-((1,1-dimethylethyl)amino)-3-(2-(1-(1H-indol-4-yl)ethenyl)phenoxy)-, monohydrochloride, (+-)-RefChem:265583DTXSID609283771-(tert-Butylamino)-3-{2-[1-(1H-indol-4-yl)ethen-1-yl]phenoxy}propan-2-ol--hydrogen chloride (1/1)1-(tert-Butylamino)-3-{2-[1-(1H-indol-4-yl)ethenyl]phenoxy}propan-2-ol--hydrogen chloride (1/1)
Database identifiers
- CAS
133994-77-1- PubChem CID
- 3077201
- DTXSID
DTXSID60928377
Properties
Computed structural properties
- Topological polar surface area
- 57.3 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 487
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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