0X2
2,6-dichloro-N-(2-oxo-2,5-dihydropyridin-4-yl)benzamide
Created: | 2012-08-17 |
Last modified: | 2013-06-19 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 26 |
Chiral Atom Count | 0 |
Bond Count | 27 |
Aromatic Bond Count | 6 |
Chemical Component Summary | |
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Name | 2,6-dichloro-N-(2-oxo-2,5-dihydropyridin-4-yl)benzamide |
Systematic Name (OpenEye OEToolkits) | 2,6-bis(chloranyl)-N-(6-oxidanylidene-3H-pyridin-4-yl)benzamide |
Formula | C12 H8 Cl2 N2 O2 |
Molecular Weight | 283.11 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C2N=CCC(NC(=O)c1c(Cl)cccc1Cl)=C2 |
SMILES | CACTVS | 3.370 | Clc1cccc(Cl)c1C(=O)NC2=CC(=O)N=CC2 |
SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(c(c(c1)Cl)C(=O)NC2=CC(=O)N=CC2)Cl |
Canonical SMILES | CACTVS | 3.370 | Clc1cccc(Cl)c1C(=O)NC2=CC(=O)N=CC2 |
Canonical SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(c(c(c1)Cl)C(=O)NC2=CC(=O)N=CC2)Cl |
InChI | InChI | 1.03 | InChI=1S/C12H8Cl2N2O2/c13-8-2-1-3-9(14)11(8)12(18)16-7-4-5-15-10(17)6-7/h1-3,5-6H,4H2,(H,16,18) |
InChIKey | InChI | 1.03 | HKIJJBMBTHKEPC-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 137347906 |