ALV
Summary
Name: | (2S)-2-aminopropane-1,1-diol |
Formula: | C3 H9 N O2 |
Formal charge: | 0 |
Formula weight: | 91.109 Da |
Component type: | peptide-like |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | (2S)-2-aminopropane-1,1-diol |
OpenEye OEToolkits | 1.7.0 | (2S)-2-azanylpropane-1,1-diol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | OC(O)C(N)C |
SMILES_CANONICAL | CACTVS | 3.370 | C[C@H](N)C(O)O |
SMILES | CACTVS | 3.370 | C[CH](N)C(O)O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C[C@@H](C(O)O)N |
SMILES | OpenEye OEToolkits | 1.7.0 | CC(C(O)O)N |
InChI | InChI | 1.03 | InChI=1S/C3H9NO2/c1-2(4)3(5)6/h2-3,5-6H,4H2,1H3/t2-/m0/s1 |
InChIKey | InChI | 1.03 | QEKPBYCXURULNE-REOHCLBHSA-N |