Basic information
- CAS
41734-89-8- Standard SMILES
COc1ccc2c3ccc(Cl)cc3n(CCC[NH+](C)C)c2c1.O=C([O-])C(=O)O- InChIKey
AAZHUVOGSCDTKW-UHFFFAOYSA-N- Molecular formula
- C20H23ClN2O5
- Average molar mass
- 406.9 g/mol
- Monoisotopic mass
- 406.1295495
Names & identifiers
- Preferred name
- Carbazole, 2-chloro-9-(3-dimethylaminopropyl)-7-methoxy-, oxalate
- IUPAC
- 3-(2-chloro-7-methoxycarbazol-9-yl)propyl-dimethylazanium;2-hydroxy-2-oxoacetate
Names & synonyms
41734-89-8CARBAZOLE, 2-CHLORO-9-(3-DIMETHYLAMINOPROPYL)-7-METHOXY-, OXALATE2-Chloro-9-(3-dimethylaminopropyl)-7-methoxycarbazole oxalateDTXSID601945559H-Carbazol-9-propanamine, 2-chloro-N,N-dimethyl-7-methoxy-, oxalatePropylamine, 3-(2-chloro-7-methoxycarbazol-9-yl)-N,N-dimethyl-, oxalateRefChem:333264DTXCID001170463-(2-Chloro-7-methoxy-9H-carbazol-9-yl)-N,N-dimethylpropan-1-aminium hydrogen ethanedioate
Database identifiers
- CAS
41734-89-8- PubChem CID
- 39018
- DTXSID
DTXSID60194555
Properties
Computed structural properties
- Topological polar surface area
- 96 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 443
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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