GT2
Summary
Name: | 4-chloranyl-3-[(2,4-dichlorophenyl)carbonylamino]-~{N}-oxidanyl-benzamide |
Formula: | C14 H9 Cl3 N2 O3 |
Formal charge: | 0 |
Formula weight: | 359.592 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 4-chloranyl-3-[(2,4-dichlorophenyl)carbonylamino]-~{N}-oxidanyl-benzamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C14H9Cl3N2O3/c15-8-2-3-9(11(17)6-8)14(21)18-12-5-7(13(20)19-22)1-4-10(12)16/h1-6,22H,(H,18,21)(H,19,20) |
InChIKey | InChI | 1.03 | UYUPOQDZJBPUTQ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | ONC(=O)c1ccc(Cl)c(NC(=O)c2ccc(Cl)cc2Cl)c1 |
SMILES | CACTVS | 3.385 | ONC(=O)c1ccc(Cl)c(NC(=O)c2ccc(Cl)cc2Cl)c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(c(cc1C(=O)NO)NC(=O)c2ccc(cc2Cl)Cl)Cl |
SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(c(cc1C(=O)NO)NC(=O)c2ccc(cc2Cl)Cl)Cl |