N-Allylnornuciferine
Basic information
- CAS
35936-72-2- Standard SMILES
C=CCN1CCc2cc(OC)c(OC)c3c2[C@H]1Cc1ccccc1-3- InChIKey
AYSSSOUCEZIHII-QGZVFWFLSA-N- Molecular formula
- C21H23NO2
- Average molar mass
- 321.4 g/mol
- Monoisotopic mass
- 321.17287898
Names & identifiers
- Preferred name
- N-Allylnornuciferine
- IUPAC
- (6aR)-1,2-dimethoxy-6-prop-2-enyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline
Names & synonyms
N-AllylnornuciferineBRN 154907735936-72-2DTXSID40189500(R)-5,6,6a,7-Tetrahydro-1,2-dimethoxy-6-(2-propenyl)-4H-dibenzo(de,g)quinoline4H-Dibenzo(de,g)quinoline, 5,6,6a,7-tetrahydro-1,2-dimethoxy-6-(2-propenyl)-, (R)-RefChem:363176DTXCID30111991(6ar)-1,2-dimethoxy-6-(prop-2-en-1-yl)-5,6,6a,7-tetrahydro-4h-dibenzo[de,g]quinoline
Database identifiers
- CAS
35936-72-2- PubChem CID
- 215613
- DTXSID
DTXSID40189500
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 21.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 453
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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