5TO
Summary
Name: | 3-cyclopentyl-1-pyrrolidin-1-yl-propan-1-one |
Formula: | C12 H21 N O |
Formal charge: | 0 |
Formula weight: | 195.301 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.4 | 3-cyclopentyl-1-pyrrolidin-1-yl-propan-1-one |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C12H21NO/c14-12(13-9-3-4-10-13)8-7-11-5-1-2-6-11/h11H,1-10H2 |
InChIKey | InChI | 1.03 | QNSQANVPHXTUQU-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | O=C(CCC1CCCC1)N2CCCC2 |
SMILES | CACTVS | 3.385 | O=C(CCC1CCCC1)N2CCCC2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | C1CCC(C1)CCC(=O)N2CCCC2 |
SMILES | OpenEye OEToolkits | 2.0.4 | C1CCC(C1)CCC(=O)N2CCCC2 |