JBH
Summary
Name: | 3,4-dihydroquinazolin-4-ol |
Formula: | C8 H8 N2 O |
Formal charge: | 0 |
Formula weight: | 148.162 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 3,4-dihydroquinazolin-4-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C8H8N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-5,8,11H,(H,9,10)/t8-/m1/s1 |
InChIKey | InChI | 1.03 | RFXUVQZRJWPTLS-MRVPVSSYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | O[C@H]1NC=Nc2ccccc12 |
SMILES | CACTVS | 3.385 | O[CH]1NC=Nc2ccccc12 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)C(NC=N2)O |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)C(NC=N2)O |