(1S,9S,10S)-3,4-dimethoxy-17-methyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene;hydrochloride
Basic information
- CAS
65058-33-5- Standard SMILES
COc1ccc2c(c1OC)[C@]13CCCC[C@@H]1[C@H](C2)N(C)CC3.Cl- InChIKey
KQWZCCAMNFWBFT-LYKJBEOTSA-N- Molecular formula
- C19H28ClNO2
- Average molar mass
- 337.9 g/mol
- Monoisotopic mass
- 337.1808568
Names & identifiers
- Preferred name
- (1S,9S,10S)-3,4-dimethoxy-17-methyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene;hydrochloride
- IUPAC
- (1S,9S,10S)-3,4-dimethoxy-17-methyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene;hydrochloride
Names & synonyms
NSC295609NSC-29560965058-33-5
Database identifiers
- CAS
65058-33-5- PubChem CID
- 5359062
Properties
Computed structural properties
- Topological polar surface area
- 21.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 414
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Compound notes
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