CLW
Summary
Name: | CHLORZOXAZONE |
Synonyms: | 5-CHLORO-2-BENZOXAZOLONE |
Formula: | C7 H4 Cl N O2 |
Formal charge: | 0 |
Formula weight: | 169.565 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 5-chloro-1,3-benzoxazol-2(3H)-one |
OpenEye OEToolkits | 1.5.0 | 5-chloro-3H-1,3-benzoxazol-2-one |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | Clc2cc1c(OC(=O)N1)cc2 |
SMILES_CANONICAL | CACTVS | 3.341 | Clc1ccc2OC(=O)Nc2c1 |
SMILES | CACTVS | 3.341 | Clc1ccc2OC(=O)Nc2c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc2c(cc1Cl)NC(=O)O2 |
SMILES | OpenEye OEToolkits | 1.5.0 | c1cc2c(cc1Cl)NC(=O)O2 |
InChI | InChI | 1.03 | InChI=1S/C7H4ClNO2/c8-4-1-2-6-5(3-4)9-7(10)11-6/h1-3H,(H,9,10) |
InChIKey | InChI | 1.03 | TZFWDZFKRBELIQ-UHFFFAOYSA-N |