ZRJ
Summary
| Name: | tert-butyl (2S)-2-amino-2-(3,5-dimethoxyphenyl)acetate |
| Synonyms: | ~{tert}-butyl 2-azanyl-2-(3,5-dimethoxyphenyl)ethanoate |
| Formula: | C14 H21 N O4 |
| Formal charge: | 0 |
| Formula weight: | 267.321 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{tert}-butyl 2-azanyl-2-(3,5-dimethoxyphenyl)ethanoate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C14H21NO4/c1-14(2,3)19-13(16)12(15)9-6-10(17-4)8-11(7-9)18-5/h6-8,12H,15H2,1-5H3/t12-/m0/s1 |
| InChIKey | InChI | 1.06 | AWJOCNUVOGUIHD-LBPRGKRZSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cc(OC)cc(c1)[C@H](N)C(=O)OC(C)(C)C |
| SMILES | CACTVS | 3.385 | COc1cc(OC)cc(c1)[CH](N)C(=O)OC(C)(C)C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)(C)OC(=O)C(c1cc(cc(c1)OC)OC)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)(C)OC(=O)C(c1cc(cc(c1)OC)OC)N |
