tridecan-2-yl 5-chloranylpyrazine-2-carboxylate

Systemtic Name: tridecan-2-yl 5-chloranylpyrazine-2-carboxylate Openeye Name: 1-methyldodecyl 5-chloropyrazine-2-carboxylate CAS Name: 5-chloro-2-pyrazinecarboxylic acid tridecan-2-yl ester IUPAC Name: tridecan-2-yl 5-chloropyrazine-2-carboxylate Traditional Name: 5-chloropyrazinic acid 1-methyldodecyl ester Formula: C18H29ClN2O2 MolecularWeight: 340.88806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C)OC(=O)C1=CN=C(C=N1)Cl

Isomeric SMILES

CCCCCCCCCCCC(C)OC(=O)C1=CN=C(C=N1)Cl

InChI

InChI=1S/C18H29ClN2O2/c1-3-4-5-6-7-8-9-10-11-12-15(2)23-18(22)16-13-21-17(19)14-20-16/h13-15H,3-12H2,1-2H3