5-octoxycarbonylpyrazine-2-carboxylic acid

Systemtic Name: 5-octoxycarbonylpyrazine-2-carboxylic acid Openeye Name: 5-octoxycarbonylpyrazine-2-carboxylic acid CAS Name: 5-[octoxy(oxo)methyl]-2-pyrazinecarboxylic acid IUPAC Name: 5-octoxycarbonylpyrazine-2-carboxylic acid Traditional Name: 5-octoxycarbonylpyrazinoic acid Formula: C14H20N2O4 MolecularWeight: 280.3196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=NC=C(N=C1)C(=O)O

Isomeric SMILES

CCCCCCCCOC(=O)C1=NC=C(N=C1)C(=O)O

InChI

InChI=1S/C14H20N2O4/c1-2-3-4-5-6-7-8-20-14(19)12-10-15-11(9-16-12)13(17)18/h9-10H,2-8H2,1H3,(H,17,18)