heptyl 5-chloranylpyrazine-2-carboxylate

Systemtic Name: heptyl 5-chloranylpyrazine-2-carboxylate Openeye Name: heptyl 5-chloropyrazine-2-carboxylate CAS Name: 5-chloro-2-pyrazinecarboxylic acid heptyl ester IUPAC Name: heptyl 5-chloropyrazine-2-carboxylate Traditional Name: 5-chloropyrazinic acid heptyl ester Formula: C12H17ClN2O2 MolecularWeight: 256.72858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1=CN=C(C=N1)Cl

Isomeric SMILES

CCCCCCCOC(=O)C1=CN=C(C=N1)Cl

InChI

InChI=1S/C12H17ClN2O2/c1-2-3-4-5-6-7-17-12(16)10-8-15-11(13)9-14-10/h8-9H,2-7H2,1H3