3J8
Summary
| Name: | 5-methylphenazin-1(5H)-one |
| Synonyms: | Pyocyanin Pyrocyanine; Sanasin; Sanazin |
| Formula: | C13 H10 N2 O |
| Formal charge: | 0 |
| Formula weight: | 210.231 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 5-methylphenazin-1(5H)-one |
| OpenEye OEToolkits | 1.7.2 | 5-methylphenazin-1-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C3C2=Nc1c(cccc1)N(C2=CC=C3)C |
| InChI | InChI | 1.03 | InChI=1S/C13H10N2O/c1-15-10-6-3-2-5-9(10)14-13-11(15)7-4-8-12(13)16/h2-8H,1H3 |
| InChIKey | InChI | 1.03 | YNCMLFHHXWETLD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CN1c2ccccc2N=C3C(=O)C=CC=C13 |
| SMILES | CACTVS | 3.370 | CN1c2ccccc2N=C3C(=O)C=CC=C13 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | CN1c2ccccc2N=C3C1=CC=CC3=O |
| SMILES | OpenEye OEToolkits | 1.7.2 | CN1c2ccccc2N=C3C1=CC=CC3=O |
