Basic information
- CAS
73019-09-7- Standard SMILES
COS(=O)(=O)[O-].Cc1ccc(N(C)N=CC2=[N+](C)c3ccccc3C2(C)C)cc1- InChIKey
WYYPHFSXWSKRQJ-UHFFFAOYSA-M- Molecular formula
- C21H27N3O4S
- Average molar mass
- 417.5 g/mol
- Monoisotopic mass
- 417.17222752
Overview
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Names & identifiers
- Preferred name
- N,4-dimethyl-N-[(1,3,3-trimethylindol-1-ium-2-yl)methylideneamino]aniline;methyl sulfate
- IUPAC
- N,4-dimethyl-N-[(1,3,3-trimethylindol-1-ium-2-yl)methylideneamino]aniline;methyl sulfate
Names & synonyms
WYYPHFSXWSKRQJ-UHFFFAOYSA-MNS00058631
Database identifiers
- CAS
73019-09-7- PubChem CID
- 166404
Properties
Computed structural properties
- Topological polar surface area
- 93.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 574
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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