3-(3-pyridin-4-ylpropoxycarbonyl)pyrazine-2-carboxylate

Systemtic Name: 3-(3-pyridin-4-ylpropoxycarbonyl)pyrazine-2-carboxylate Openeye Name: 3-[3-(4-pyridyl)propoxycarbonyl]pyrazine-2-carboxylate CAS Name: 3-[oxo(3-pyridin-4-ylpropoxy)methyl]-2-pyrazinecarboxylate IUPAC Name: 3-(3-pyridin-4-ylpropoxycarbonyl)pyrazine-2-carboxylate Traditional Name: 3-[3-(4-pyridyl)propoxycarbonyl]pyrazinate Formula: C14H12N3O4- MolecularWeight: 286.26278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1CCCOC(=O)C2=NC=CN=C2C(=O)[O-]

Isomeric SMILES

C1=CN=CC=C1CCCOC(=O)C2=NC=CN=C2C(=O)[O-]

InChI

InChI=1S/C14H13N3O4/c18-13(19)11-12(17-8-7-16-11)14(20)21-9-1-2-10-3-5-15-6-4-10/h3-8H,1-2,9H2,(H,18,19)/p-1