GNW
Summary
| Name: | 1-[(3-chlorophenyl)methyl]piperazine |
| Formula: | C11 H15 Cl N2 |
| Formal charge: | 0 |
| Formula weight: | 210.703 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 1-[(3-chlorophenyl)methyl]piperazine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C11H15ClN2/c12-11-3-1-2-10(8-11)9-14-6-4-13-5-7-14/h1-3,8,13H,4-7,9H2 |
| InChIKey | InChI | 1.03 | JTEQMTYOCBFLNH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Clc1cccc(CN2CCNCC2)c1 |
| SMILES | CACTVS | 3.385 | Clc1cccc(CN2CCNCC2)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(cc(c1)Cl)CN2CCNCC2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(cc(c1)Cl)CN2CCNCC2 |
