ethyl 3-[2-[(3-fluorophenyl)methyl]-5-oxidanylidene-3-phenyl-1,2,4-triazin-6-yl]propanoate

Systemtic Name: ethyl 3-[2-[(3-fluorophenyl)methyl]-5-oxidanylidene-3-phenyl-1,2,4-triazin-6-yl]propanoate Openeye Name: ethyl 3-[2-[(3-fluorophenyl)methyl]-5-oxo-3-phenyl-1,2,4-triazin-6-yl]propanoate CAS Name: 3-[2-[(3-fluorophenyl)methyl]-5-oxo-3-phenyl-1,2,4-triazin-6-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[2-[(3-fluorophenyl)methyl]-5-oxo-3-phenyl-1,2,4-triazin-6-yl]propanoate Traditional Name: 3-[2-(3-fluorobenzyl)-5-keto-3-phenyl-1,2,4-triazin-6-yl]propionic acid ethyl ester Formula: C21H20FN3O3 MolecularWeight: 381.400203

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=NN(C(=NC1=O)C2=CC=CC=C2)CC3=CC(=CC=C3)F

Isomeric SMILES

CCOC(=O)CCC1=NN(C(=NC1=O)C2=CC=CC=C2)CC3=CC(=CC=C3)F

InChI

InChI=1S/C21H20FN3O3/c1-2-28-19(26)12-11-18-21(27)23-20(16-8-4-3-5-9-16)25(24-18)14-15-7-6-10-17(22)13-15/h3-10,13H,2,11-12,14H2,1H3