SSK
Summary
| Name: | (1S,2S)-1,2-diphenylethane-1,2-diamine |
| Formula: | C14 H16 N2 |
| Formal charge: | 0 |
| Formula weight: | 212.29 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (1S,2S)-1,2-diphenylethane-1,2-diamine |
| OpenEye OEToolkits | 1.9.2 | (1S,2S)-1,2-diphenylethane-1,2-diamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | NC(C(N)c1ccccc1)c2ccccc2 |
| InChI | InChI | 1.03 | InChI=1S/C14H16N2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,13-14H,15-16H2/t13-,14-/m0/s1 |
| InChIKey | InChI | 1.03 | PONXTPCRRASWKW-KBPBESRZSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@H]([C@@H](N)c1ccccc1)c2ccccc2 |
| SMILES | CACTVS | 3.385 | N[CH]([CH](N)c1ccccc1)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1ccc(cc1)[C@@H]([C@H](c2ccccc2)N)N |
| SMILES | OpenEye OEToolkits | 1.9.2 | c1ccc(cc1)C(C(c2ccccc2)N)N |
