Basic information
- CAS
78109-81-6- Standard SMILES
CCCCOc1ccccc1C(=O)NCCC[NH+](CC)CC.[Cl-]- InChIKey
WYCWAIKAFWQRCU-UHFFFAOYSA-N- Molecular formula
- C18H31ClN2O2
- Average molar mass
- 342.9 g/mol
- Monoisotopic mass
- 342.2074059
Names & identifiers
- Preferred name
- Benzamide, o-butoxy-N-(3-(diethylamino)propyl)-, hydrochloride
- IUPAC
- 3-[(2-butoxybenzoyl)amino]propyl-diethylazanium chloride
Names & synonyms
D-63878109-81-6o-Butoxy-N-(3-(diethylamino)propyl)benzamide hydrochloride2-Butoxybenzoesaeure-3'-diaethylaminopropylamid (1') hydrochlorid [German]BENZAMIDE, o-BUTOXY-N-(3-(DIETHYLAMINO)PROPYL)-, HYDROCHLORIDE2-Butoxybenzoesaeure-3'-diaethylaminopropylamid (1') hydrochloridRefChem:322550
Database identifiers
- CAS
78109-81-6- PubChem CID
- 54083
Properties
Computed structural properties
- Topological polar surface area
- 42.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 11
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 293
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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