RHP
Summary
Name: | (3R)-3-(PROP-2-YNYLAMINO)INDAN-5-OL |
Synonyms: | 5-HYDROXY-N-PROPARGYL-1(R)-AMINOINDAN |
Formula: | C12 H13 N O |
Formal charge: | 0 |
Formula weight: | 187.238 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | (3R)-3-(prop-2-yn-1-ylamino)-2,3-dihydro-1H-inden-5-ol |
OpenEye OEToolkits | 1.5.0 | (3R)-3-(prop-2-ynylamino)-2,3-dihydro-1H-inden-5-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | Oc1ccc2c(c1)C(NCC#C)CC2 |
SMILES_CANONICAL | CACTVS | 3.341 | Oc1ccc2CC[C@@H](NCC#C)c2c1 |
SMILES | CACTVS | 3.341 | Oc1ccc2CC[CH](NCC#C)c2c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C#CCN[C@@H]1CCc2c1cc(cc2)O |
SMILES | OpenEye OEToolkits | 1.5.0 | C#CCNC1CCc2c1cc(cc2)O |
InChI | InChI | 1.03 | InChI=1S/C12H13NO/c1-2-7-13-12-6-4-9-3-5-10(14)8-11(9)12/h1,3,5,8,12-14H,4,6-7H2/t12-/m1/s1 |
InChIKey | InChI | 1.03 | NRSDGDXUWMMUEV-GFCCVEGCSA-N |