A1IB1
Summary
| Name: | 4-(phenylmethyl)piperidine |
| Formula: | C12 H17 N |
| Formal charge: | 0 |
| Formula weight: | 175.27 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 4-(phenylmethyl)piperidine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C12H17N/c1-2-4-11(5-3-1)10-12-6-8-13-9-7-12/h1-5,12-13H,6-10H2 |
| InChIKey | InChI | 1.06 | ABGXADJDTPFFSZ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C1CC(CCN1)Cc2ccccc2 |
| SMILES | CACTVS | 3.385 | C1CC(CCN1)Cc2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)CC2CCNCC2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)CC2CCNCC2 |
