GWG
1-methylindazole-3-carboxamide
Created: | 2018-06-01 |
Last modified: | 2018-07-18 |
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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 | 10 |
Chemical Component Summary | |
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Name | 1-methylindazole-3-carboxamide |
Systematic Name (OpenEye OEToolkits) | 1-methylindazole-3-carboxamide |
Formula | C9 H9 N3 O |
Molecular Weight | 175.187 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | Cn1nc(C(N)=O)c2ccccc12 |
SMILES | OpenEye OEToolkits | 2.0.6 | Cn1c2ccccc2c(n1)C(=O)N |
Canonical SMILES | CACTVS | 3.385 | Cn1nc(C(N)=O)c2ccccc12 |
Canonical SMILES | OpenEye OEToolkits | 2.0.6 | Cn1c2ccccc2c(n1)C(=O)N |
InChI | InChI | 1.03 | InChI=1S/C9H9N3O/c1-12-7-5-3-2-4-6(7)8(11-12)9(10)13/h2-5H,1H3,(H2,10,13) |
InChIKey | InChI | 1.03 | PVROETJHCUDAFG-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 21699713 |