WCW
Summary
| Name: | 4-azanyl-1-phenyl-piperidine-4-carboxylic acid |
| Formula: | C12 H16 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 220.268 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 4-azanyl-1-phenyl-piperidine-4-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C12H16N2O2/c13-12(11(15)16)6-8-14(9-7-12)10-4-2-1-3-5-10/h1-5H,6-9,13H2,(H,15,16) |
| InChIKey | InChI | 1.06 | FPGAOFXYANTSRQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC1(CCN(CC1)c2ccccc2)C(O)=O |
| SMILES | CACTVS | 3.385 | NC1(CCN(CC1)c2ccccc2)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)N2CCC(CC2)(C(=O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)N2CCC(CC2)(C(=O)O)N |
