3-(azepan-1-ylcarbonyl)pyrazine-2-carboxylate

Systemtic Name: 3-(azepan-1-ylcarbonyl)pyrazine-2-carboxylate Openeye Name: 3-(azepane-1-carbonyl)pyrazine-2-carboxylate CAS Name: 3-[1-azepanyl(oxo)methyl]-2-pyrazinecarboxylate IUPAC Name: 3-(azepane-1-carbonyl)pyrazine-2-carboxylate Traditional Name: 3-(azepane-1-carbonyl)pyrazinate Formula: C12H14N3O3- MolecularWeight: 248.25786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=NC=CN=C2C(=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=NC=CN=C2C(=O)[O-]

InChI

InChI=1S/C12H15N3O3/c16-11(15-7-3-1-2-4-8-15)9-10(12(17)18)14-6-5-13-9/h5-6H,1-4,7-8H2,(H,17,18)/p-1