11Z
Summary
Name: | 11-cyclohexylundecanoic acid |
Formula: | C17 H32 O2 |
Formal charge: | 0 |
Formula weight: | 268.435 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 11-cyclohexylundecanoic acid |
OpenEye OEToolkits | 1.7.6 | 11-cyclohexylundecanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)CCCCCCCCCCC1CCCCC1 |
InChI | InChI | 1.03 | InChI=1S/C17H32O2/c18-17(19)15-11-6-4-2-1-3-5-8-12-16-13-9-7-10-14-16/h16H,1-15H2,(H,18,19) |
InChIKey | InChI | 1.03 | WFTPSUGFEZHCGU-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)CCCCCCCCCCC1CCCCC1 |
SMILES | CACTVS | 3.385 | OC(=O)CCCCCCCCCCC1CCCCC1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C1CCC(CC1)CCCCCCCCCCC(=O)O |
SMILES | OpenEye OEToolkits | 1.7.6 | C1CCC(CC1)CCCCCCCCCCC(=O)O |