7MU
4-chloranyl-~{N}-methyl-pyridine-2-carboxamide
Created: | 2016-11-21 |
Last modified: | 2017-04-12 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 18 |
Chiral Atom Count | 0 |
Bond Count | 18 |
Aromatic Bond Count | 6 |
Chemical Component Summary | |
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Name | 4-chloranyl-~{N}-methyl-pyridine-2-carboxamide |
Systematic Name (OpenEye OEToolkits) | 4-chloranyl-~{N}-methyl-pyridine-2-carboxamide |
Formula | C7 H7 Cl N2 O |
Molecular Weight | 170.596 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | CNC(=O)c1cc(Cl)ccn1 |
SMILES | OpenEye OEToolkits | 2.0.6 | CNC(=O)c1cc(ccn1)Cl |
Canonical SMILES | CACTVS | 3.385 | CNC(=O)c1cc(Cl)ccn1 |
Canonical SMILES | OpenEye OEToolkits | 2.0.6 | CNC(=O)c1cc(ccn1)Cl |
InChI | InChI | 1.03 | InChI=1S/C7H7ClN2O/c1-9-7(11)6-4-5(8)2-3-10-6/h2-4H,1H3,(H,9,11) |
InChIKey | InChI | 1.03 | BGVBBMZMEKXUTR-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 1476814 |
ChEMBL | CHEMBL4163507 |