89E
Summary
| Name: | 3-pyridin-4-yl-2,4-dihydroindeno[1,2-c]pyrazole |
| Formula: | C15 H11 N3 |
| Formal charge: | 0 |
| Formula weight: | 233.268 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (8aP)-3-(pyridin-4-yl)-2,4-dihydroindeno[1,2-c]pyrazole |
| OpenEye OEToolkits | 2.0.7 | 3-pyridin-4-yl-2,4-dihydroindeno[1,2-c]pyrazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1cc2c(Cc3c2n[NH]c3c2ccncc2)cc1 |
| InChI | InChI | 1.03 | InChI=1S/C15H11N3/c1-2-4-12-11(3-1)9-13-14(17-18-15(12)13)10-5-7-16-8-6-10/h1-8H,9H2,(H,17,18) |
| InChIKey | InChI | 1.03 | NHOACLCXCKJMAK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C1c2ccccc2c3n[nH]c(c13)c4ccncc4 |
| SMILES | CACTVS | 3.385 | C1c2ccccc2c3n[nH]c(c13)c4ccncc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc-2c(c1)Cc3c2n[nH]c3c4ccncc4 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc-2c(c1)Cc3c2n[nH]c3c4ccncc4 |
