4ZY
Summary
| Name: | 4-(aminomethyl)aniline |
| Formula: | C7 H10 N2 |
| Formal charge: | 0 |
| Formula weight: | 122.168 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-(aminomethyl)aniline |
| OpenEye OEToolkits | 1.9.2 | 4-(aminomethyl)aniline |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | NCc1ccc(N)cc1 |
| InChI | InChI | 1.03 | InChI=1S/C7H10N2/c8-5-6-1-3-7(9)4-2-6/h1-4H,5,8-9H2 |
| InChIKey | InChI | 1.03 | BFWYZZPDZZGSLJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NCc1ccc(N)cc1 |
| SMILES | CACTVS | 3.385 | NCc1ccc(N)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1cc(ccc1CN)N |
| SMILES | OpenEye OEToolkits | 1.9.2 | c1cc(ccc1CN)N |
