A2Z
Summary
| Name: | 6,9-dimethyl[1,3]dioxolo[4,5-h]quinolin-8(9H)-one |
| Formula: | C12 H11 N O3 |
| Formal charge: | 0 |
| Formula weight: | 217.221 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 6,9-dimethyl[1,3]dioxolo[4,5-h]quinolin-8(9H)-one |
| OpenEye OEToolkits | 1.7.0 | 6,9-dimethyl-[1,3]dioxolo[4,5-h]quinolin-8-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C1C=C(c3c(N1C)c2OCOc2cc3)C |
| SMILES_CANONICAL | CACTVS | 3.370 | CN1C(=O)C=C(C)c2ccc3OCOc3c12 |
| SMILES | CACTVS | 3.370 | CN1C(=O)C=C(C)c2ccc3OCOc3c12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | CC1=CC(=O)N(c2c1ccc3c2OCO3)C |
| SMILES | OpenEye OEToolkits | 1.7.0 | CC1=CC(=O)N(c2c1ccc3c2OCO3)C |
| InChI | InChI | 1.03 | InChI=1S/C12H11NO3/c1-7-5-10(14)13(2)11-8(7)3-4-9-12(11)16-6-15-9/h3-5H,6H2,1-2H3 |
| InChIKey | InChI | 1.03 | FEMZVADPTYXZIF-UHFFFAOYSA-N |
