(4,6-dioctoxy-1,3,5-triazin-2-yl)methyl 2-cyanoethanoate

Systemtic Name: (4,6-dioctoxy-1,3,5-triazin-2-yl)methyl 2-cyanoethanoate Openeye Name: (4,6-dioctoxy-1,3,5-triazin-2-yl)methyl 2-cyanoacetate CAS Name: 2-cyanoacetic acid (4,6-dioctoxy-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4,6-dioctoxy-1,3,5-triazin-2-yl)methyl 2-cyanoacetate Traditional Name: 2-cyanoacetic acid (4,6-dioctoxy-s-triazin-2-yl)methyl ester Formula: C23H38N4O4 MolecularWeight: 434.57222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=NC(=NC(=N1)COC(=O)CC#N)OCCCCCCCC

Isomeric SMILES

CCCCCCCCOC1=NC(=NC(=N1)COC(=O)CC#N)OCCCCCCCC

InChI

InChI=1S/C23H38N4O4/c1-3-5-7-9-11-13-17-29-22-25-20(19-31-21(28)15-16-24)26-23(27-22)30-18-14-12-10-8-6-4-2/h3-15,17-19H2,1-2H3