FZ6
(2R)-2-azanyl-3-oxidanyl-N-[3-(trifluoromethyloxy)phenyl]propanamide
Created: | 2020-07-08 |
Last modified: | 2020-12-02 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 29 |
Chiral Atom Count | 1 |
Bond Count | 29 |
Aromatic Bond Count | 6 |
Chemical Component Summary | |
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Name | (2R)-2-azanyl-3-oxidanyl-N-[3-(trifluoromethyloxy)phenyl]propanamide |
Systematic Name (OpenEye OEToolkits) | (2~{R})-2-azanyl-3-oxidanyl-~{N}-[3-(trifluoromethyloxy)phenyl]propanamide |
Formula | C10 H11 F3 N2 O3 |
Molecular Weight | 264.201 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | N[CH](CO)C(=O)Nc1cccc(OC(F)(F)F)c1 |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)OC(F)(F)F)NC(=O)C(CO)N |
Canonical SMILES | CACTVS | 3.385 | N[C@H](CO)C(=O)Nc1cccc(OC(F)(F)F)c1 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)OC(F)(F)F)NC(=O)[C@@H](CO)N |
InChI | InChI | 1.03 | InChI=1S/C10H11F3N2O3/c11-10(12,13)18-7-3-1-2-6(4-7)15-9(17)8(14)5-16/h1-4,8,16H,5,14H2,(H,15,17)/t8-/m1/s1 |
InChIKey | InChI | 1.03 | QKKNXONMXNVCIX-MRVPVSSYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 142480001 |