Basic information
- CAS
39493-95-3- Standard SMILES
Cl.O=C(CCN1CCC[C@H]2CCCC[C@@H]21)Nc1c(Cl)cccc1Cl- InChIKey
VIDFKXOLJFMNTC-CACIRBSMSA-N- Molecular formula
- C18H25Cl3N2O
- Average molar mass
- 391.8 g/mol
- Monoisotopic mass
- 390.103247
Names & identifiers
- Preferred name
- N-(2,6-Dichlorophenyl)-3-(octahydroquinolin-1(2H)-yl)propanimidic acid--hydrogen chloride (1/1)
- IUPAC
- 3-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-N-(2,6-dichlorophenyl)propanamide;hydrochloride
- English name
- 1(2H)-Quinolinepropanamide, N-(2,6-dichlorophenyl)octahydro-, monohydr ochloride, trans-
- Molecular weight
- 0
Names & synonyms
39493-95-3DTXSID40960119N-(2,6-Dichlorophenyl)-3-(octahydroquinolin-1(2H)-yl)propanimidic acid--hydrogen chloride (1/1)RefChem:1090881DTXCID001387984trans-N-(2,6-Dichlorophenyl)octahydro-1(2H)-quinolinepropanamide monohydrochloride1(2H)-Quinolinepropanamide, N-(2,6-dichlorophenyl)octahydro-, monohydrochloride, trans-N-(2,6-Dichlorophenyl)-3-[(4aR,8aS)-octahydro-1(2H)-quinolinyl]propanamide hydrochloride3-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-N-(2,6-dichlorophenyl)propanamide hydrochlorideDB-217856N-(2,6-Dichlorophenyl)-3-[(4aR,8aS)-octahydroquinolin-1(2H)-yl]propanimidic acid--hydrogen chloride (1/1)1(2H)-Quinolinepropanamide, N-(2,6-dichlorophenyl)octahydro-, monohydr ochloride, trans-
Database identifiers
- CAS
39493-95-3- PubChem CID
- 217705
- DTXSID
DTXSID40960119
Properties
Computed structural properties
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 396
Chemistry & industry
Suppliers2 total
HONEST JOY HOLDINGS LIMITED[email protected]
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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