2-chloranyl-2-[5-(4-dodecylphenyl)pyrazin-2-yl]propanoate

Systemtic Name: 2-chloranyl-2-[5-(4-dodecylphenyl)pyrazin-2-yl]propanoate Openeye Name: 2-chloro-2-[5-(4-dodecylphenyl)pyrazin-2-yl]propanoate CAS Name: 2-chloro-2-[5-(4-dodecylphenyl)-2-pyrazinyl]propanoate IUPAC Name: 2-chloro-2-[5-(4-dodecylphenyl)pyrazin-2-yl]propanoate Traditional Name: 2-chloro-2-[5-(4-laurylphenyl)pyrazin-2-yl]propionate Formula: C25H34ClN2O2- MolecularWeight: 430.00266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C2=CN=C(C=N2)C(C)(C(=O)[O-])Cl

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C2=CN=C(C=N2)C(C)(C(=O)[O-])Cl

InChI

InChI=1S/C25H35ClN2O2/c1-3-4-5-6-7-8-9-10-11-12-13-20-14-16-21(17-15-20)22-18-28-23(19-27-22)25(2,26)24(29)30/h14-19H,3-13H2,1-2H3,(H,29,30)/p-1