JHV
Summary
| Name: | 4-chloro-N~1~-(pyridin-4-yl)benzene-1,2-diamine |
| Formula: | C11 H10 Cl N3 |
| Formal charge: | 0 |
| Formula weight: | 219.67 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-chloro-N~1~-(pyridin-4-yl)benzene-1,2-diamine |
| OpenEye OEToolkits | 2.0.6 | 4-chloranyl-~{N}1-pyridin-4-yl-benzene-1,2-diamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1(ccncc1)Nc2ccc(cc2N)Cl |
| InChI | InChI | 1.03 | InChI=1S/C11H10ClN3/c12-8-1-2-11(10(13)7-8)15-9-3-5-14-6-4-9/h1-7H,13H2,(H,14,15) |
| InChIKey | InChI | 1.03 | LSMXFIQZRFSQBH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1cc(Cl)ccc1Nc2ccncc2 |
| SMILES | CACTVS | 3.385 | Nc1cc(Cl)ccc1Nc2ccncc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(c(cc1Cl)N)Nc2ccncc2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(c(cc1Cl)N)Nc2ccncc2 |
