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

Systemtic Name: (4,6-diphenoxy-1,3,5-triazin-2-yl)methyl 2-cyanoethanoate Openeye Name: (4,6-diphenoxy-1,3,5-triazin-2-yl)methyl 2-cyanoacetate CAS Name: 2-cyanoacetic acid (4,6-diphenoxy-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4,6-diphenoxy-1,3,5-triazin-2-yl)methyl 2-cyanoacetate Traditional Name: 2-cyanoacetic acid (4,6-diphenoxy-s-triazin-2-yl)methyl ester Formula: C19H14N4O4 MolecularWeight: 362.33886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=NC(=NC(=N2)COC(=O)CC#N)OC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)OC2=NC(=NC(=N2)COC(=O)CC#N)OC3=CC=CC=C3

InChI

InChI=1S/C19H14N4O4/c20-12-11-17(24)25-13-16-21-18(26-14-7-3-1-4-8-14)23-19(22-16)27-15-9-5-2-6-10-15/h1-10H,11,13H2