Basic information
- Standard SMILES
CCN(CC)c1ccc(C(=C2C(c3ccccc3)=[N+](C)c3ccccc32)c2ccccc2Cl)cc1- InChIKey
KLNQPSPRKMTVAF-UHFFFAOYSA-N- Molecular formula
- C32H30ClN2+
- Average molar mass
- 478 g/mol
- Monoisotopic mass
- 477.2097517
Names & identifiers
- Preferred name
- 4-[(2-chlorophenyl)-(1-methyl-2-phenylindol-1-ium-3-ylidene)methyl]-N,N-diethylaniline
- IUPAC
- 4-[(2-chlorophenyl)-(1-methyl-2-phenylindol-1-ium-3-ylidene)methyl]-N,N-diethylaniline
Names & synonyms
SCHEMBL4655679
Database identifiers
- PubChem CID
- 166320
Properties
Computed structural properties
- XLogP
- 8.4
- Topological polar surface area
- 6.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 35
- Formal charge
- 1
- Complexity
- 766
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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