NHG
Summary
| Name: | BIS-NORESEROLINE |
| Formula: | C11 H14 N2 O |
| Formal charge: | 0 |
| Formula weight: | 190.242 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (3aS,8aR)-3a-methyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-ol |
| OpenEye OEToolkits | 1.7.2 | (3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-pyrrolo[2,3-b]indol-7-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Oc1cc2c(cc1)NC3NCCC23C |
| InChI | InChI | 1.03 | InChI=1S/C11H14N2O/c1-11-4-5-12-10(11)13-9-3-2-7(14)6-8(9)11/h2-3,6,10,12-14H,4-5H2,1H3/t10-,11+/m1/s1 |
| InChIKey | InChI | 1.03 | BLEHTFVVORLVPX-MNOVXSKESA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | C[C@@]12CCN[C@@H]1Nc3ccc(O)cc23 |
| SMILES | CACTVS | 3.370 | C[C]12CCN[CH]1Nc3ccc(O)cc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | C[C@@]12CCN[C@@H]1Nc3c2cc(cc3)O |
| SMILES | OpenEye OEToolkits | 1.7.2 | CC12CCNC1Nc3c2cc(cc3)O |
