(2-methyl-4-oxidanylidene-3-phenyl-chromen-7-yl) 1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxylate

Systemtic Name: (2-methyl-4-oxidanylidene-3-phenyl-chromen-7-yl) 1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxylate Openeye Name: (2-methyl-4-oxo-3-phenyl-chromen-7-yl) 1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxylate CAS Name: 1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid (2-methyl-4-oxo-3-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (2-methyl-4-oxo-3-phenylchromen-7-yl) 1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid (4-keto-2-methyl-3-phenyl-chromen-7-yl) ester Formula: C26H18FN3O4 MolecularWeight: 455.437223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=NN(C(=N3)C)C4=CC=C(C=C4)F)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3=NN(C(=N3)C)C4=CC=C(C=C4)F)C5=CC=CC=C5

InChI

InChI=1S/C26H18FN3O4/c1-15-23(17-6-4-3-5-7-17)24(31)21-13-12-20(14-22(21)33-15)34-26(32)25-28-16(2)30(29-25)19-10-8-18(27)9-11-19/h3-14H,1-2H3