6,9-Dihydro-6,9-ethanobenzo[g]isoquinoline-5,10-dione
Basic information
- CAS
96937-79-0- Standard SMILES
O=C1C2=C(C(=O)c3cnccc31)C1C=CC2CC1- InChIKey
NCNRQBOCQNWNKQ-UHFFFAOYSA-N- Molecular formula
- C15H11NO2
- Average molar mass
- 237.25 g/mol
- Monoisotopic mass
- 237.07897859
Names & identifiers
- Preferred name
- 6,9-Dihydro-6,9-ethanobenzo[g]isoquinoline-5,10-dione
- IUPAC
- 6-azatetracyclo[10.2.2.02,11.04,9]hexadeca-2(11),4(9),5,7,13-pentaene-3,10-dione
Names & synonyms
96937-79-0NSC338698SCHEMBL4199726,10-dione, 6,9-dihydro-6,9-Dihydro-6,9-ethanobenzo[g]isoquinoline-5,10-dioneDTXSID40319042NSC-338698
Database identifiers
- CAS
96937-79-0- PubChem CID
- 334273
- DTXSID
DTXSID40319042
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 47 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 503
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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