UJ8
Summary
| Name: | (~{S})-1~{H}-benzimidazol-2-yl-(4-propan-2-ylphenyl)methanol |
| Formula: | C17 H18 N2 O |
| Formal charge: | 0 |
| Formula weight: | 266.338 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (~{S})-1~{H}-benzimidazol-2-yl-(4-propan-2-ylphenyl)methanol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C17H18N2O/c1-11(2)12-7-9-13(10-8-12)16(20)17-18-14-5-3-4-6-15(14)19-17/h3-11,16,20H,1-2H3,(H,18,19)/t16-/m0/s1 |
| InChIKey | InChI | 1.03 | ALKXKMROLUPKRL-INIZCTEOSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)c1ccc(cc1)[C@H](O)c2[nH]c3ccccc3n2 |
| SMILES | CACTVS | 3.385 | CC(C)c1ccc(cc1)[CH](O)c2[nH]c3ccccc3n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)c1ccc(cc1)[C@@H](c2[nH]c3ccccc3n2)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)c1ccc(cc1)C(c2[nH]c3ccccc3n2)O |
