[4-oxidanylidene-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 5-chloranyl-1,3-diphenyl-pyrazole-4-carboxylate

Systemtic Name: [4-oxidanylidene-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 5-chloranyl-1,3-diphenyl-pyrazole-4-carboxylate Openeye Name: [4-oxo-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 5-chloro-1,3-diphenyl-pyrazole-4-carboxylate CAS Name: 5-chloro-1,3-diphenyl-4-pyrazolecarboxylic acid [4-oxo-3-phenoxy-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [4-oxo-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 5-chloro-1,3-diphenylpyrazole-4-carboxylate Traditional Name: 5-chloro-1,3-diphenyl-pyrazole-4-carboxylic acid [4-keto-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] ester Formula: C32H18ClF3N2O5 MolecularWeight: 602.94393

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=C2C(=O)OC3=CC4=C(C=C3)C(=O)C(=C(O4)C(F)(F)F)OC5=CC=CC=C5)Cl)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=C2C(=O)OC3=CC4=C(C=C3)C(=O)C(=C(O4)C(F)(F)F)OC5=CC=CC=C5)Cl)C6=CC=CC=C6

InChI

InChI=1S/C32H18ClF3N2O5/c33-30-25(26(19-10-4-1-5-11-19)37-38(30)20-12-6-2-7-13-20)31(40)42-22-16-17-23-24(18-22)43-29(32(34,35)36)28(27(23)39)41-21-14-8-3-9-15-21/h1-18H