K0L
Summary
| Name: | (4-amino-2,6-dimethylphenoxy)acetic acid |
| Formula: | C10 H13 N O3 |
| Formal charge: | 0 |
| Formula weight: | 195.215 Da |
| Component type: | peptide-like |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (4-amino-2,6-dimethylphenoxy)acetic acid |
| OpenEye OEToolkits | 1.7.0 | 2-(4-azanyl-2,6-dimethyl-phenoxy)ethanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)COc1c(cc(cc1C)N)C |
| SMILES_CANONICAL | CACTVS | 3.370 | Cc1cc(N)cc(C)c1OCC(O)=O |
| SMILES | CACTVS | 3.370 | Cc1cc(N)cc(C)c1OCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | Cc1cc(cc(c1OCC(=O)O)C)N |
| SMILES | OpenEye OEToolkits | 1.7.0 | Cc1cc(cc(c1OCC(=O)O)C)N |
| InChI | InChI | 1.03 | InChI=1S/C10H13NO3/c1-6-3-8(11)4-7(2)10(6)14-5-9(12)13/h3-4H,5,11H2,1-2H3,(H,12,13) |
| InChIKey | InChI | 1.03 | VBBVKAACCNVDOH-UHFFFAOYSA-N |
