G2Z
Summary
Name: | [(2~{S})-2-azanylpropyl]carbamic acid |
Formula: | C4 H10 N2 O2 |
Formal charge: | 0 |
Formula weight: | 118.134 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | [(2~{S})-2-azanylpropyl]carbamic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C4H10N2O2/c1-3(5)2-6-4(7)8/h3,6H,2,5H2,1H3,(H,7,8)/t3-/m0/s1 |
InChIKey | InChI | 1.03 | RHDKRUOESWZLQS-VKHMYHEASA-N |
SMILES_CANONICAL | CACTVS | 3.385 | C[C@H](N)CNC(O)=O |
SMILES | CACTVS | 3.385 | C[CH](N)CNC(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | C[C@@H](CNC(=O)O)N |
SMILES | OpenEye OEToolkits | 2.0.6 | CC(CNC(=O)O)N |