6RN
Summary
Name: | 4-methoxy-N-[(pyridin-2-yl)methyl]aniline |
Formula: | C13 H14 N2 O |
Formal charge: | 0 |
Formula weight: | 214.263 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 4-methoxy-N-[(pyridin-2-yl)methyl]aniline |
OpenEye OEToolkits | 2.0.7 | 4-methoxy-~{N}-(pyridin-2-ylmethyl)aniline |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c2(NCc1ncccc1)ccc(OC)cc2 |
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 |
SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(NCc2ccccn2)cc1 |
SMILES | CACTVS | 3.385 | COc1ccc(NCc2ccccn2)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1)NCc2ccccn2 |
SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1)NCc2ccccn2 |