5-(4-undecoxyphenyl)pyrazine-2-carboxylate

Systemtic Name: 5-(4-undecoxyphenyl)pyrazine-2-carboxylate Openeye Name: 5-(4-undecoxyphenyl)pyrazine-2-carboxylate CAS Name: 5-(4-undecoxyphenyl)-2-pyrazinecarboxylate IUPAC Name: 5-(4-undecoxyphenyl)pyrazine-2-carboxylate Traditional Name: 5-(4-undecoxyphenyl)pyrazinate Formula: C22H29N2O3- MolecularWeight: 369.47726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC1=CC=C(C=C1)C2=CN=C(C=N2)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCOC1=CC=C(C=C1)C2=CN=C(C=N2)C(=O)[O-]

InChI

InChI=1S/C22H30N2O3/c1-2-3-4-5-6-7-8-9-10-15-27-19-13-11-18(12-14-19)20-16-24-21(17-23-20)22(25)26/h11-14,16-17H,2-10,15H2,1H3,(H,25,26)/p-1