49R
Summary
| Name: | tert-butyl (3R)-1,2,3,4-tetrahydroquinolin-3-ylcarbamate |
| Formula: | C14 H20 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 248.321 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | tert-butyl (3R)-1,2,3,4-tetrahydroquinolin-3-ylcarbamate |
| OpenEye OEToolkits | 1.9.2 | tert-butyl N-[(3R)-1,2,3,4-tetrahydroquinolin-3-yl]carbamate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(OC(C)(C)C)NC2Cc1c(cccc1)NC2 |
| InChI | InChI | 1.03 | InChI=1S/C14H20N2O2/c1-14(2,3)18-13(17)16-11-8-10-6-4-5-7-12(10)15-9-11/h4-7,11,15H,8-9H2,1-3H3,(H,16,17)/t11-/m1/s1 |
| InChIKey | InChI | 1.03 | GAURNOYXRZQBNV-LLVKDONJSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)(C)OC(=O)N[C@H]1CNc2ccccc2C1 |
| SMILES | CACTVS | 3.385 | CC(C)(C)OC(=O)N[CH]1CNc2ccccc2C1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CC(C)(C)OC(=O)N[C@@H]1Cc2ccccc2NC1 |
| SMILES | OpenEye OEToolkits | 1.9.2 | CC(C)(C)OC(=O)NC1Cc2ccccc2NC1 |
