Basic information
- CAS
63906-88-7- Standard SMILES
O=C(NC(CC[NH+]1CCCCC1)c1ccccc1)c1ccccc1.[Cl-]- InChIKey
YVBOFDGPWVOQBW-UHFFFAOYSA-N- Molecular formula
- C21H27ClN2O
- Average molar mass
- 358.9 g/mol
- Monoisotopic mass
- 358.1811912
Names & identifiers
- Preferred name
- Digammacaine
- IUPAC
- N-(1-phenyl-3-piperidin-1-ium-1-ylpropyl)benzamide chloride
Names & synonyms
DigammacaineUNII-D9RYZ2DW8T63906-88-7D9RYZ2DW8T1-Benzamido-1-phenyl-3-piperidinopropane hydrochloridePiperidine, N-(3-benzamido-3-phenyl)propyl-, hydrochlorideBENZAMIDE, N-(alpha-(2-(PIPERIDINO)ETHYL)BENZYL)-, HYDROCHLORIDELS-27382RefChem:133619(+-)-DIGAMMACAINEDIGAMMACAINE, (+-)-N-(1-phenyl-3-piperidin-1-ium-1-ylpropyl)benzamide;chloride
Database identifiers
- CAS
63906-88-7- PubChem CID
- 45176
Properties
Computed structural properties
- Topological polar surface area
- 33.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 366
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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