QVB
Summary
| Name: | 5-chloranyl-6-fluoranyl-3-(2-propan-2-yloxyphenyl)-1~{H}-indole-2-carboxamide |
| Formula: | C18 H16 Cl F N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 346.783 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5-chloranyl-6-fluoranyl-3-(2-propan-2-yloxyphenyl)-1~{H}-indole-2-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C18H16ClFN2O2/c1-9(2)24-15-6-4-3-5-10(15)16-11-7-12(19)13(20)8-14(11)22-17(16)18(21)23/h3-9,22H,1-2H3,(H2,21,23) |
| InChIKey | InChI | 1.03 | CNUHFUPIGPUPON-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)Oc1ccccc1c2c([nH]c3cc(F)c(Cl)cc23)C(N)=O |
| SMILES | CACTVS | 3.385 | CC(C)Oc1ccccc1c2c([nH]c3cc(F)c(Cl)cc23)C(N)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)Oc1ccccc1c2c3cc(c(cc3[nH]c2C(=O)N)F)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)Oc1ccccc1c2c3cc(c(cc3[nH]c2C(=O)N)F)Cl |
