V3W
Summary
Name: | 4-(4-methoxypiperidin-1-yl)carbonylbenzaldehyde |
Formula: | C14 H17 N O3 |
Formal charge: | 0 |
Formula weight: | 247.29 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 4-(4-methoxypiperidin-1-yl)carbonylbenzaldehyde |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C14H17NO3/c1-18-13-6-8-15(9-7-13)14(17)12-4-2-11(10-16)3-5-12/h2-5,10,13H,6-9H2,1H3 |
InChIKey | InChI | 1.03 | ZOMLYGRJHVNCLW-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COC1CCN(CC1)C(=O)c2ccc(C=O)cc2 |
SMILES | CACTVS | 3.385 | COC1CCN(CC1)C(=O)c2ccc(C=O)cc2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COC1CCN(CC1)C(=O)c2ccc(cc2)C=O |
SMILES | OpenEye OEToolkits | 2.0.7 | COC1CCN(CC1)C(=O)c2ccc(cc2)C=O |