UWU
Summary
| Name: | 6-chloranyl-7-oxidanyl-4-phenyl-chromen-2-one |
| Formula: | C15 H9 Cl O3 |
| Formal charge: | 0 |
| Formula weight: | 272.683 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 6-chloro-7-hydroxy-4-phenyl-2H-chromen-2-one |
| OpenEye OEToolkits | 1.9.2 | 6-chloranyl-7-oxidanyl-4-phenyl-chromen-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Clc2c(O)cc1OC(=O)C=C(c1c2)c3ccccc3 |
| InChI | InChI | 1.03 | InChI=1S/C15H9ClO3/c16-12-6-11-10(9-4-2-1-3-5-9)7-15(18)19-14(11)8-13(12)17/h1-8,17H |
| InChIKey | InChI | 1.03 | TUQNFQUMZKUALD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Oc1cc2OC(=O)C=C(c3ccccc3)c2cc1Cl |
| SMILES | CACTVS | 3.385 | Oc1cc2OC(=O)C=C(c3ccccc3)c2cc1Cl |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1ccc(cc1)C2=CC(=O)Oc3c2cc(c(c3)O)Cl |
| SMILES | OpenEye OEToolkits | 1.9.2 | c1ccc(cc1)C2=CC(=O)Oc3c2cc(c(c3)O)Cl |
