04V
Summary
Name: | (2S)-pyrrolidine-2-carboximidic acid |
Formula: | C5 H10 N2 O |
Formal charge: | 0 |
Formula weight: | 114.146 Da |
Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | (2S)-pyrrolidine-2-carboximidic acid |
OpenEye OEToolkits | 1.9.2 | (2S)-pyrrolidine-2-carboximidic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | [N@H]=C(O)C1NCCC1 |
InChI | InChI | 1.03 | InChI=1S/C5H10N2O/c6-5(8)4-2-1-3-7-4/h4,7H,1-3H2,(H2,6,8)/t4-/m0/s1 |
InChIKey | InChI | 1.03 | VLJNHYLEOZPXFW-BYPYZUCNSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OC(=N)[C@@H]1CCCN1 |
SMILES | CACTVS | 3.385 | OC(=N)[CH]1CCCN1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | [H]/N=C(/[C@@H]1CCCN1)\O |
SMILES | OpenEye OEToolkits | 1.9.2 | C1CC(NC1)C(=N)O |