QOX
Summary
Name: | 1-oxo-1lambda~5~-quinoline |
Formula: | C9 H7 N O |
Formal charge: | 0 |
Formula weight: | 145.158 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 1-oxo-1lambda~5~-quinoline |
OpenEye OEToolkits | 2.0.7 | 1-oxidanidylquinolin-1-ium |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | [O-][n+]1cccc2ccccc21 |
InChI | InChI | 1.06 | InChI=1S/C9H7NO/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H |
InChIKey | InChI | 1.06 | GIIWGCBLYNDKBO-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | [O-][n+]1cccc2ccccc12 |
SMILES | CACTVS | 3.385 | [O-][n+]1cccc2ccccc12 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)ccc[n+]2[O-] |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)ccc[n+]2[O-] |