L1Q
2,3,5,6-tetrakis(fluoranyl)-4-propyl-benzenesulfonamide
Created: | 2019-07-13 |
Last modified: | 2020-04-15 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 26 |
Chiral Atom Count | 0 |
Bond Count | 26 |
Aromatic Bond Count | 6 |
Chemical Component Summary | |
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Name | 2,3,5,6-tetrakis(fluoranyl)-4-propyl-benzenesulfonamide |
Systematic Name (OpenEye OEToolkits) | 2,3,5,6-tetrakis(fluoranyl)-4-propyl-benzenesulfonamide |
Formula | C9 H9 F4 N O2 S |
Molecular Weight | 271.232 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | CCCc1c(F)c(F)c(c(F)c1F)[S](N)(=O)=O |
SMILES | OpenEye OEToolkits | 2.0.7 | CCCc1c(c(c(c(c1F)F)S(=O)(=O)N)F)F |
Canonical SMILES | CACTVS | 3.385 | CCCc1c(F)c(F)c(c(F)c1F)[S](N)(=O)=O |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | CCCc1c(c(c(c(c1F)F)S(=O)(=O)N)F)F |
InChI | InChI | 1.03 | InChI=1S/C9H9F4NO2S/c1-2-3-4-5(10)7(12)9(17(14,15)16)8(13)6(4)11/h2-3H2,1H3,(H2,14,15,16) |
InChIKey | InChI | 1.03 | QCRSPYSAXKPYLP-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 146019249 |