Basic information
- CAS
18235-90-0- Standard SMILES
CCOC(=O)c1c(C)n(C)c2ccc(OCC[NH+](C)C)cc12.[Cl-]- InChIKey
NPPSHVLQTXRBHF-UHFFFAOYSA-N- Molecular formula
- C17H25ClN2O3
- Average molar mass
- 340.8 g/mol
- Monoisotopic mass
- 340.1553704
Names & identifiers
- Preferred name
- OF 2498
- IUPAC
- 2-(3-ethoxycarbonyl-1,2-dimethylindol-5-yl)oxyethyl-dimethylazanium chloride
Names & synonyms
Of-249818235-90-0OF 2498Indole-3-carboxylic acid, 1,2-dimethyl-5-(2-(dimethylamino)ethoxy)-, ethyl ester, monohydrochlorideRefChem:366959
Database identifiers
- CAS
18235-90-0- PubChem CID
- 28982
Properties
Computed structural properties
- Topological polar surface area
- 44.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 375
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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