hexadecyl 2-(3,5,6-trimethylpyrazin-2-yl)ethanoate

Systemtic Name: hexadecyl 2-(3,5,6-trimethylpyrazin-2-yl)ethanoate Openeye Name: hexadecyl 2-(3,5,6-trimethylpyrazin-2-yl)acetate CAS Name: 2-(3,5,6-trimethyl-2-pyrazinyl)acetic acid hexadecyl ester IUPAC Name: hexadecyl 2-(3,5,6-trimethylpyrazin-2-yl)acetate Traditional Name: 2-(3,5,6-trimethylpyrazin-2-yl)acetic acid cetyl ester Formula: C25H44N2O2 MolecularWeight: 404.62906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)CC1=NC(=C(N=C1C)C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)CC1=NC(=C(N=C1C)C)C

InChI

InChI=1S/C25H44N2O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-29-25(28)20-24-23(4)26-21(2)22(3)27-24/h5-20H2,1-4H3