6RN
4-methoxy-N-[(pyridin-2-yl)methyl]aniline
Created: | 2016-06-07 |
Last modified: | 2019-02-08 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 30 |
Chiral Atom Count | 0 |
Bond Count | 31 |
Aromatic Bond Count | 12 |
Chemical Component Summary | |
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Name | 4-methoxy-N-[(pyridin-2-yl)methyl]aniline |
Systematic Name (OpenEye OEToolkits) | 4-methoxy-~{N}-(pyridin-2-ylmethyl)aniline |
Formula | C13 H14 N2 O |
Molecular Weight | 214.263 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c2(NCc1ncccc1)ccc(OC)cc2 |
SMILES | CACTVS | 3.385 | COc1ccc(NCc2ccccn2)cc1 |
SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1)NCc2ccccn2 |
Canonical SMILES | CACTVS | 3.385 | COc1ccc(NCc2ccccn2)cc1 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1)NCc2ccccn2 |
InChI | InChI | 1.03 | InChI=1S/C13H14N2O/c1-16-13-7-5-11(6-8-13)15-10-12-4-2-3-9-14-12/h2-9,15H,10H2,1H3 |
InChIKey | InChI | 1.03 | VZYUNDIQWDHYLW-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 409183 |