0OK
Summary
Name: | 3-phenylquinazolin-4(3H)-one |
Formula: | C14 H10 N2 O |
Formal charge: | 0 |
Formula weight: | 222.242 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 3-phenylquinazolin-4(3H)-one |
OpenEye OEToolkits | 1.7.6 | 3-phenylquinazolin-4-one |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C1c3ccccc3N=CN1c2ccccc2 |
InChI | InChI | 1.03 | InChI=1S/C14H10N2O/c17-14-12-8-4-5-9-13(12)15-10-16(14)11-6-2-1-3-7-11/h1-10H |
InChIKey | InChI | 1.03 | WAIHFZPSLVDBRV-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | O=C1N(C=Nc2ccccc12)c3ccccc3 |
SMILES | CACTVS | 3.370 | O=C1N(C=Nc2ccccc12)c3ccccc3 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)N2C=Nc3ccccc3C2=O |
SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)N2C=Nc3ccccc3C2=O |