6-methyltridecan-6-yl 5-chloranylpyrazine-2-carboxylate

Systemtic Name: 6-methyltridecan-6-yl 5-chloranylpyrazine-2-carboxylate Openeye Name: (1-methyl-1-pentyl-octyl) 5-chloropyrazine-2-carboxylate CAS Name: 5-chloro-2-pyrazinecarboxylic acid 6-methyltridecan-6-yl ester IUPAC Name: 6-methyltridecan-6-yl 5-chloropyrazine-2-carboxylate Traditional Name: 5-chloropyrazinic acid (1-amyl-1-methyl-octyl) ester Formula: C19H31ClN2O2 MolecularWeight: 354.91464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C)(CCCCC)OC(=O)C1=CN=C(C=N1)Cl

Isomeric SMILES

CCCCCCCC(C)(CCCCC)OC(=O)C1=CN=C(C=N1)Cl

InChI

InChI=1S/C19H31ClN2O2/c1-4-6-8-9-11-13-19(3,12-10-7-5-2)24-18(23)16-14-22-17(20)15-21-16/h14-15H,4-13H2,1-3H3