LJA
Summary
Name: | N-[3-(carbamoylamino)phenyl]acetamide |
Formula: | C9 H11 N3 O2 |
Formal charge: | 0 |
Formula weight: | 193.203 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | N-[3-(carbamoylamino)phenyl]acetamide |
OpenEye OEToolkits | 2.0.6 | ~{N}-[3-(aminocarbonylamino)phenyl]ethanamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | N(C(C)=O)c1cccc(c1)NC(N)=O |
InChI | InChI | 1.03 | InChI=1S/C9H11N3O2/c1-6(13)11-7-3-2-4-8(5-7)12-9(10)14/h2-5H,1H3,(H,11,13)(H3,10,12,14) |
InChIKey | InChI | 1.03 | GVNXANNAMKHSRF-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)Nc1cccc(NC(N)=O)c1 |
SMILES | CACTVS | 3.385 | CC(=O)Nc1cccc(NC(N)=O)c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(=O)Nc1cccc(c1)NC(=O)N |
SMILES | OpenEye OEToolkits | 2.0.6 | CC(=O)Nc1cccc(c1)NC(=O)N |