Basic information
- CAS
78109-79-2- Standard SMILES
CCCCOc1ccccc1C(=O)NCCC[NH+](CCO)CCO.[Cl-]- InChIKey
GXMOIEKILRTEOG-UHFFFAOYSA-N- Molecular formula
- C18H31ClN2O4
- Average molar mass
- 374.9 g/mol
- Monoisotopic mass
- 374.1972352
Names & identifiers
- Preferred name
- Benzamide, o-butoxy-N-(3-(bis(2-hydroxyethyl)amino)propyl)-, hydrochloride
- IUPAC
- 3-[(2-butoxybenzoyl)amino]propyl-bis(2-hydroxyethyl)azanium chloride
Names & synonyms
78109-79-2N-(3-(Bis(2-hydroxyethyl)amino)propyl)benzamide hydrochlorideD-695BENZAMIDE, o-BUTOXY-N-(3-(BIS(2-HYDROXYETHYL)AMINO)PROPYL)-, HYDROCHLORIDERefChem:322549
Database identifiers
- CAS
78109-79-2- PubChem CID
- 54079
Properties
Computed structural properties
- Topological polar surface area
- 83.2 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 13
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 322
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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