GXY
Summary
| Name: | 4-bromo-2,5-dimethoxyaniline |
| Formula: | C8 H10 Br N O2 |
| Formal charge: | 0 |
| Formula weight: | 232.074 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-bromo-2,5-dimethoxyaniline |
| OpenEye OEToolkits | 2.0.6 | 4-bromanyl-2,5-dimethoxy-aniline |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | COc1cc(Br)c(OC)cc1N |
| InChI | InChI | 1.03 | InChI=1S/C8H10BrNO2/c1-11-7-4-6(10)8(12-2)3-5(7)9/h3-4H,10H2,1-2H3 |
| InChIKey | InChI | 1.03 | YLONQFVJDASUEB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cc(Br)c(OC)cc1N |
| SMILES | CACTVS | 3.385 | COc1cc(Br)c(OC)cc1N |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | COc1cc(c(cc1Br)OC)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | COc1cc(c(cc1Br)OC)N |
