2-[2-[2-(1H-imidazol-5-yl)ethylamino]ethyl]propanedioic acid

Systemtic Name: 2-[2-[2-(1H-imidazol-5-yl)ethylamino]ethyl]propanedioic acid Openeye Name: 2-[2-[2-(1H-imidazol-5-yl)ethylamino]ethyl]propanedioic acid CAS Name: 2-[2-[2-(1H-imidazol-5-yl)ethylamino]ethyl]propanedioic acid IUPAC Name: 2-[2-[2-(1H-imidazol-5-yl)ethylamino]ethyl]propanedioic acid Traditional Name: 2-[2-[2-(1H-imidazol-5-yl)ethylamino]ethyl]malonic acid Formula: C10H15N3O4 MolecularWeight: 241.2438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)CCNCCC(C(=O)O)C(=O)O

Isomeric SMILES

C1=C(NC=N1)CCNCCC(C(=O)O)C(=O)O

InChI

InChI=1S/C10H15N3O4/c14-9(15)8(10(16)17)2-4-11-3-1-7-5-12-6-13-7/h5-6,8,11H,1-4H2,(H,12,13)(H,14,15)(H,16,17)