J51
Summary
Name: | benzyl acetylcarbamate |
Formula: | C10 H11 N O3 |
Formal charge: | 0 |
Formula weight: | 193.199 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | benzyl acetylcarbamate |
OpenEye OEToolkits | 2.0.6 | (phenylmethyl) ~{N}-ethanoylcarbamate |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | N(C(OCc1ccccc1)=O)C(C)=O |
InChI | InChI | 1.03 | InChI=1S/C10H11NO3/c1-8(12)11-10(13)14-7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,11,12,13) |
InChIKey | InChI | 1.03 | IMSURJCYZMGADJ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)NC(=O)OCc1ccccc1 |
SMILES | CACTVS | 3.385 | CC(=O)NC(=O)OCc1ccccc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(=O)NC(=O)OCc1ccccc1 |
SMILES | OpenEye OEToolkits | 2.0.6 | CC(=O)NC(=O)OCc1ccccc1 |