Basic information
- CAS
52757-89-8- Standard SMILES
COc1ccc(N(C)N=CC2=[N+](C)c3ccccc3C2(C)C)cc1- InChIKey
VRAOBFWNUBUCRN-UHFFFAOYSA-N- Molecular formula
- C20H24N3O+
- Average molar mass
- 322.4 g/mol
- Monoisotopic mass
- 322.1919374
Names & identifiers
- Preferred name
- Ctionic yellow X-GL
- IUPAC
- 4-methoxy-N-methyl-N-[(1,3,3-trimethylindol-1-ium-2-yl)methylideneamino]aniline
Names & synonyms
Ctionic yellow X-GL52757-89-82-[[2-(4-Methoxyphenyl)-2-methylhydrazinylidene]methyl]-1,3,3-trimethyl-3H-indoliumK2JP5FL78ESCHEMBL12573888DTXSID008659342-{[2-(4-Methoxyphenyl)-2-methylhydrazinylidene]methyl}-1,3,3-trimethyl-3H-indol-1-ium3H-Indolium, 2-[[2-(4-methoxyphenyl)-2-methylhydrazinylidene]methyl]-1,3,3-trimethyl-
Database identifiers
- CAS
52757-89-8- PubChem CID
- 40980
- DTXSID
DTXSID00865934- UNII
- K2JP5FL78E
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 27.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 1
- Complexity
- 503
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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