Basic information
- CAS
136471-32-4- Standard SMILES
CC1=C(C(=O)OC2CC3CCC2(C)C3(C)C)C2Nc3ccccc3N(C)C2O1- InChIKey
DZCIUYJBFWBQJD-UHFFFAOYSA-N- Molecular formula
- C23H30N2O3
- Average molar mass
- 382.5 g/mol
- Monoisotopic mass
- 382.22564282
Names & identifiers
- Preferred name
- 1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl 2,9-dimethyl-3a,4,9,9a-tetrahydrofuro[2,3-b]quinoxaline-3-carboxylate
- IUPAC
- (1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl) 2,9-dimethyl-4,9a-dihydro-3aH-furo[3,2-b]quinoxaline-3-carboxylate
Names & synonyms
NSC661582Furo[2, 3a,4,9,9a-tetrahydro-2,9-dimethyl-,1,7,7-trimethylbicyclo[2.2.1]hept-2-yl esterNSC6956431,7,7-Trimethylbicyclo[2.2.1]hept-2-yl 2,9-dimethyl-3a,4,9,9a-tetrahydrofuro[2,3-b]quinoxaline-3-carboxylateCHEMBL2006290DTXSID00929444NSC-661582NSC-695643NCI60_034218Furo[2, 3a,4,9,9a-tetrahydro-2,9-dimethyl-, isobornyl ester,(R-exo)Furo[2, 3a,4,9,9a-tetrahydro-2,9-dimethyl-, isobornyl ester,(R-exo)-(1,7,7-trimethylnorbornan-2-yl) 2,9-dimethyl-4,9a-dihydro-3aH-furo[3,2-b]quinoxaline-3-carboxylate
Show more names
1,7,7-Trimethylbicyclo[2.2.1]heptan-2-yl 2,9-dimethyl-3a,4,9,9a-tetrahydrofuro[2,3-b]quinoxaline-3-carboxylate
Database identifiers
- CAS
136471-32-4- PubChem CID
- 378680
- DTXSID
DTXSID00929444
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 50.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 717
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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