Basic information
- CAS
35690-87-0- Standard SMILES
COc1cc2c3c(c1OC)C(=O)CCC3N(C)CC2- InChIKey
IKDQGVYHJNOUCS-UHFFFAOYSA-N- Molecular formula
- C15H19NO3
- Average molar mass
- 261.32 g/mol
- Monoisotopic mass
- 261.13649347
Names & identifiers
- Preferred name
- 7H-Benzo(de)quinolin-7-one, 1,2,3,8,9,9a-hexahydro-5,6-dimethoxy-1-methyl-
- IUPAC
- 5,6-dimethoxy-1-methyl-3,8,9,9a-tetrahydro-2H-benzo[de]quinolin-7-one
Names & synonyms
35690-87-07H-Benzo(de)quinolin-7-one, 1,2,3,8,9,9a-hexahydro-5,6-dimethoxy-1-methyl-RefChem:10745665,6-Dimethoxy-1-methyl-1,2,3,8,9,9a-hexahydro-7H-benzo(de)quinolin-7-one5,6-Dimethoxy-1-methyl-2,3,9,9a-tetrahydro-1H-benzo[de]quinolin-7(8H)-oneBRN 1542353NSC1877752,3,7,8,9,9a-Hexahydro-5,6-dimethoxy-1-methyl-1H-benzo(de)chinolin-7-on [German]SCHEMBL10639161DTXSID3013850442,3,7,8,9,9a-Hexahydro-5,6-dimethoxy-1-methyl-1H-benzo(de)chinolin-7-onNSC 187775
Show more names
NSC-187775
Database identifiers
- CAS
35690-87-0- PubChem CID
- 99722
- DTXSID
DTXSID301385044
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 359
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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