F04
Summary
Name: | 2-ETHYL-4-METHYL-PHTHALAZIN-1-ONE |
Formula: | C11 H12 N2 O |
Formal charge: | 0 |
Formula weight: | 188.226 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 1.6.1 | 2-ethyl-4-methyl-phthalazin-1-one |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES_CANONICAL | CACTVS | 3.352 | CCN1N=C(C)c2ccccc2C1=O |
SMILES | CACTVS | 3.352 | CCN1N=C(C)c2ccccc2C1=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | CCN1C(=O)c2ccccc2C(=N1)C |
SMILES | OpenEye OEToolkits | 1.6.1 | CCN1C(=O)c2ccccc2C(=N1)C |
InChI | InChI | 1.03 | InChI=1S/C11H12N2O/c1-3-13-11(14)10-7-5-4-6-9(10)8(2)12-13/h4-7H,3H2,1-2H3 |
InChIKey | InChI | 1.03 | ITVFFHLKZDWITI-UHFFFAOYSA-N |