5-methylundecan-5-yl 5-chloranylpyrazine-2-carboxylate

Systemtic Name: 5-methylundecan-5-yl 5-chloranylpyrazine-2-carboxylate Openeye Name: (1-butyl-1-methyl-heptyl) 5-chloropyrazine-2-carboxylate CAS Name: 5-chloro-2-pyrazinecarboxylic acid 5-methylundecan-5-yl ester IUPAC Name: 5-methylundecan-5-yl 5-chloropyrazine-2-carboxylate Traditional Name: 5-chloropyrazinic acid (1-butyl-1-methyl-heptyl) ester Formula: C17H27ClN2O2 MolecularWeight: 326.86148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(CCCC)OC(=O)C1=CN=C(C=N1)Cl

Isomeric SMILES

CCCCCCC(C)(CCCC)OC(=O)C1=CN=C(C=N1)Cl

InChI

InChI=1S/C17H27ClN2O2/c1-4-6-8-9-11-17(3,10-7-5-2)22-16(21)14-12-20-15(18)13-19-14/h12-13H,4-11H2,1-3H3