8HJ
Summary
Name: | 7-oxidanyl-3,4-dihydro-1~{H}-quinolin-2-one |
Formula: | C9 H9 N O2 |
Formal charge: | 0 |
Formula weight: | 163.173 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 7-oxidanyl-3,4-dihydro-1~{H}-quinolin-2-one |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C9H9NO2/c11-7-3-1-6-2-4-9(12)10-8(6)5-7/h1,3,5,11H,2,4H2,(H,10,12) |
InChIKey | InChI | 1.03 | LKLSFDWYIBUGNT-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Oc1ccc2CCC(=O)Nc2c1 |
SMILES | CACTVS | 3.385 | Oc1ccc2CCC(=O)Nc2c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc2c(cc1O)NC(=O)CC2 |
SMILES | OpenEye OEToolkits | 2.0.6 | c1cc2c(cc1O)NC(=O)CC2 |