UFJ
Summary
Name: | N~1~-hydroxy-N~8~-(4-iodophenyl)octanediamide |
Formula: | C14 H19 I N2 O3 |
Formal charge: | 0 |
Formula weight: | 390.217 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | N~1~-hydroxy-N~8~-(4-iodophenyl)octanediamide |
OpenEye OEToolkits | 2.0.7 | ~{N}-(4-iodophenyl)-~{N}'-oxidanyl-octanediamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c1c(ccc(c1)NC(CCCCCCC(=O)NO)=O)I |
InChI | InChI | 1.03 | InChI=1S/C14H19IN2O3/c15-11-7-9-12(10-8-11)16-13(18)5-3-1-2-4-6-14(19)17-20/h7-10,20H,1-6H2,(H,16,18)(H,17,19) |
InChIKey | InChI | 1.03 | BYVHZKAHBXINPL-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | ONC(=O)CCCCCCC(=O)Nc1ccc(I)cc1 |
SMILES | CACTVS | 3.385 | ONC(=O)CCCCCCC(=O)Nc1ccc(I)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1NC(=O)CCCCCCC(=O)NO)I |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(ccc1NC(=O)CCCCCCC(=O)NO)I |