C1R
Summary
Name: | 4-PIPERIDINEBUTYRATE |
Synonyms: | 4-PIPERIDIN-4-YLBUTANAL |
Formula: | C9 H17 N O |
Formal charge: | 0 |
Formula weight: | 155.237 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 4-piperidin-4-ylbutanal |
OpenEye OEToolkits | 1.5.0 | 4-piperidin-4-ylbutanal |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=CCCCC1CCNCC1 |
SMILES_CANONICAL | CACTVS | 3.341 | O=CCCCC1CCNCC1 |
SMILES | CACTVS | 3.341 | O=CCCCC1CCNCC1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C1CNCCC1CCCC=O |
SMILES | OpenEye OEToolkits | 1.5.0 | C1CNCCC1CCCC=O |
InChI | InChI | 1.03 | InChI=1S/C9H17NO/c11-8-2-1-3-9-4-6-10-7-5-9/h8-10H,1-7H2 |
InChIKey | InChI | 1.03 | HADYAKDSDIXWOF-UHFFFAOYSA-N |