V6Z
Summary
Name: | methyl N-(2-chlorobenzoyl)glycinate |
Formula: | C10 H10 Cl N O3 |
Formal charge: | 0 |
Formula weight: | 227.644 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | methyl N-(2-chlorobenzoyl)glycinate |
OpenEye OEToolkits | 2.0.7 | methyl 2-[(2-chlorophenyl)carbonylamino]ethanoate |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(NCC(=O)OC)c1ccccc1Cl |
InChI | InChI | 1.06 | InChI=1S/C10H10ClNO3/c1-15-9(13)6-12-10(14)7-4-2-3-5-8(7)11/h2-5H,6H2,1H3,(H,12,14) |
InChIKey | InChI | 1.06 | NVWHFQJYAXGYIN-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COC(=O)CNC(=O)c1ccccc1Cl |
SMILES | CACTVS | 3.385 | COC(=O)CNC(=O)c1ccccc1Cl |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COC(=O)CNC(=O)c1ccccc1Cl |
SMILES | OpenEye OEToolkits | 2.0.7 | COC(=O)CNC(=O)c1ccccc1Cl |