sodium 2-[5-(2-ethoxy-2-oxidanylidene-ethyl)-1H-1,2,4-triazol-3-yl]propanoate

Systemtic Name: sodium 2-[5-(2-ethoxy-2-oxidanylidene-ethyl)-1H-1,2,4-triazol-3-yl]propanoate Openeye Name: sodium 2-[5-(2-ethoxy-2-oxo-ethyl)-1H-1,2,4-triazol-3-yl]propanoate CAS Name: sodium 2-[5-(2-ethoxy-2-oxoethyl)-1H-1,2,4-triazol-3-yl]propanoate IUPAC Name: sodium 2-[5-(2-ethoxy-2-oxoethyl)-1H-1,2,4-triazol-3-yl]propanoate Traditional Name: sodium 2-[5-(2-ethoxy-2-keto-ethyl)-1H-1,2,4-triazol-3-yl]propionate Formula: C9H12N3NaO4 MolecularWeight: 249.19905

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NC(=NN1)C(C)C(=O)[O-].[Na+]

Isomeric SMILES

CCOC(=O)CC1=NC(=NN1)C(C)C(=O)[O-].[Na+]

InChI

InChI=1S/C9H13N3O4.Na/c1-3-16-7(13)4-6-10-8(12-11-6)5(2)9(14)15;/h5H,3-4H2,1-2H3,(H,14,15)(H,10,11,12);/q;+1/p-1