WMY
3-chloro-N-(1,2-oxazol-3-yl)benzamide
Created: | 2020-10-30 |
Last modified: | 2020-11-11 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 22 |
Chiral Atom Count | 0 |
Bond Count | 23 |
Aromatic Bond Count | 11 |
Chemical Component Summary | |
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Name | 3-chloro-N-(1,2-oxazol-3-yl)benzamide |
Systematic Name (OpenEye OEToolkits) | 3-chloranyl-~{N}-(1,2-oxazol-3-yl)benzamide |
Formula | C10 H7 Cl N2 O2 |
Molecular Weight | 222.628 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c1onc(c1)NC(c2cccc(c2)Cl)=O |
SMILES | CACTVS | 3.385 | Clc1cccc(c1)C(=O)Nc2ccon2 |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)Cl)C(=O)Nc2ccon2 |
Canonical SMILES | CACTVS | 3.385 | Clc1cccc(c1)C(=O)Nc2ccon2 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)Cl)C(=O)Nc2ccon2 |
InChI | InChI | 1.03 | InChI=1S/C10H7ClN2O2/c11-8-3-1-2-7(6-8)10(14)12-9-4-5-15-13-9/h1-6H,(H,12,13,14) |
InChIKey | InChI | 1.03 | YMDSPAORQHWBQI-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 1247464 |
ChEMBL | CHEMBL1478528 |