IIY
Summary
Name: | (~{N}~{E})-2-acetamido-~{N}-prop-2-enylidene-ethanamide |
Formula: | C7 H10 N2 O2 |
Formal charge: | 0 |
Formula weight: | 154.166 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | (~{N}~{E})-2-acetamido-~{N}-prop-2-enylidene-ethanamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C7H10N2O2/c1-3-4-8-7(11)5-9-6(2)10/h3-4H,1,5H2,2H3,(H,9,10)/b8-4+ |
InChIKey | InChI | 1.06 | DSHANFFIVIVYBG-XBXARRHUSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)NCC(=O)N=CC=C |
SMILES | CACTVS | 3.385 | CC(=O)NCC(=O)N=CC=C |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)NCC(=O)/N=C/C=C |
SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)NCC(=O)N=CC=C |