Basic information
- Standard SMILES
C[N+](C)(C)CCO.O=C([O-])c1cn(C2CC2)c2c(F)c(N3CCC(n4cncn4)C3)c(F)cc2c1=O- InChIKey
WASXPXAJUBXSQR-UHFFFAOYSA-M- Molecular formula
- C24H30F2N6O4
- Average molar mass
- 504.5 g/mol
Names & identifiers
- Preferred name
- N,N,N-Trimethyl-N-(2-hydroxyethyl)-ammonium 1-cyclopropyl-6,8-difluoro-7-[3-(1,2,4-triazol-1-yl)pyrrolidin-1-yl]-1,4-dihydro-4-oxoquinoline-3-carboxylate
- IUPAC
- 1-cyclopropyl-6,8-difluoro-4-oxo-7-[3-(1,2,4-triazol-1-yl)pyrrolidin-1-yl]quinoline-3-carboxylate;2-hydroxyethyl(trimethyl)azanium
Names & synonyms
SCHEMBL8131162WASXPXAJUBXSQR-UHFFFAOYSA-MN,N,N-Trimethyl-N-(2-hydroxyethyl)-ammonium 1-cyclopropyl -6,8-difluoro-7-[3-(1,2,4-triazol-1-yl)pyrrolidin-1-yl]-1,4-dihydro-4-oxoquinoline-3-carboxylate
Database identifiers
- PubChem CID
- 19006001
Properties
Computed structural properties
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 5
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 774
Related reactions
1 records
Compound notes
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