WA0
Summary
| Name: | (1R)-2-(1H-imidazol-2-yl)-1-phenylethan-1-amine |
| Formula: | C11 H13 N3 |
| Formal charge: | 0 |
| Formula weight: | 187.241 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (1R)-2-(1H-imidazol-2-yl)-1-phenylethan-1-amine |
| OpenEye OEToolkits | 2.0.7 | (1~{R})-2-(1~{H}-imidazol-2-yl)-1-phenyl-ethanamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | NC(Cc1ncc[NH]1)c1ccccc1 |
| InChI | InChI | 1.06 | InChI=1S/C11H13N3/c12-10(8-11-13-6-7-14-11)9-4-2-1-3-5-9/h1-7,10H,8,12H2,(H,13,14)/t10-/m1/s1 |
| InChIKey | InChI | 1.06 | UILZJHCFDFUHKX-SNVBAGLBSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@H](Cc1[nH]ccn1)c2ccccc2 |
| SMILES | CACTVS | 3.385 | N[CH](Cc1[nH]ccn1)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)[C@@H](Cc2[nH]ccn2)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)C(Cc2[nH]ccn2)N |
