KOM
Summary
Name: | 7,8-dihydroxy-4-phenyl-2H-chromen-2-one |
Synonyms: | 4-phenyl-7,8-dihydroxycoumarine |
Formula: | C15 H10 O4 |
Formal charge: | 0 |
Formula weight: | 254.237 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 7,8-dihydroxy-4-phenyl-2H-chromen-2-one |
OpenEye OEToolkits | 1.5.0 | 7,8-dihydroxy-4-phenyl-chromen-2-one |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C2Oc1c(O)c(O)ccc1C(=C2)c3ccccc3 |
SMILES_CANONICAL | CACTVS | 3.341 | Oc1ccc2c(OC(=O)C=C2c3ccccc3)c1O |
SMILES | CACTVS | 3.341 | Oc1ccc2c(OC(=O)C=C2c3ccccc3)c1O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)C2=CC(=O)Oc3c2ccc(c3O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)C2=CC(=O)Oc3c2ccc(c3O)O |
InChI | InChI | 1.03 | InChI=1S/C15H10O4/c16-12-7-6-10-11(9-4-2-1-3-5-9)8-13(17)19-15(10)14(12)18/h1-8,16,18H |
InChIKey | InChI | 1.03 | JRVIIPJSVKTPBK-UHFFFAOYSA-N |