IHQ
Summary
| Name: | 2-heptyl-3-iodanyl-1-oxidanyl-quinolin-4-one |
| Formula: | C16 H20 I N O2 |
| Formal charge: | 0 |
| Formula weight: | 385.24 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-heptyl-3-iodanyl-1-oxidanyl-quinolin-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C16H20INO2/c1-2-3-4-5-6-11-14-15(17)16(19)12-9-7-8-10-13(12)18(14)20/h7-10,20H,2-6,11H2,1H3 |
| InChIKey | InChI | 1.03 | KWUZRGREQVAAQR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCCCCC1=C(I)C(=O)c2ccccc2N1O |
| SMILES | CACTVS | 3.385 | CCCCCCCC1=C(I)C(=O)c2ccccc2N1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCCCCC1=C(C(=O)c2ccccc2N1O)I |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCC1=C(C(=O)c2ccccc2N1O)I |
