octan-3-yl 5-methylpyrazine-2-carboxylate

Systemtic Name: octan-3-yl 5-methylpyrazine-2-carboxylate Openeye Name: 1-ethylhexyl 5-methylpyrazine-2-carboxylate CAS Name: 5-methyl-2-pyrazinecarboxylic acid octan-3-yl ester IUPAC Name: octan-3-yl 5-methylpyrazine-2-carboxylate Traditional Name: 5-methylpyrazinic acid 1-ethylhexyl ester Formula: C14H22N2O2 MolecularWeight: 250.33668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)OC(=O)C1=CN=C(C=N1)C

Isomeric SMILES

CCCCCC(CC)OC(=O)C1=CN=C(C=N1)C

InChI

InChI=1S/C14H22N2O2/c1-4-6-7-8-12(5-2)18-14(17)13-10-15-11(3)9-16-13/h9-10,12H,4-8H2,1-3H3