U4G
Summary
| Name: | N-octylguanidine |
| Formula: | C9 H21 N3 |
| Formal charge: | 0 |
| Formula weight: | 171.283 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-octylguanidine |
| OpenEye OEToolkits | 2.0.7 | 1-octylguanidine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C(C)CCCCCCNC(\N)=N |
| InChI | InChI | 1.03 | InChI=1S/C9H21N3/c1-2-3-4-5-6-7-8-12-9(10)11/h2-8H2,1H3,(H4,10,11,12) |
| InChIKey | InChI | 1.03 | XPYXSZDENRDLKD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCCCCCNC(N)=N |
| SMILES | CACTVS | 3.385 | CCCCCCCCNC(N)=N |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | [H]/N=C(\N)/NCCCCCCCC |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCCNC(=N)N |
