1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-3,5-bis(2,4-dimethoxyphenyl)pyrazole

Systemtic Name: 1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-3,5-bis(2,4-dimethoxyphenyl)pyrazole Openeye Name: 1-[(2-chloro-4-fluoro-phenyl)methyl]-3,5-bis(2,4-dimethoxyphenyl)pyrazole CAS Name: 1-[(2-chloro-4-fluorophenyl)methyl]-3,5-bis(2,4-dimethoxyphenyl)pyrazole IUPAC Name: 1-[(2-chloro-4-fluorophenyl)methyl]-3,5-bis(2,4-dimethoxyphenyl)pyrazole Traditional Name: 1-(2-chloro-4-fluoro-benzyl)-3,5-bis(2,4-dimethoxyphenyl)pyrazole Formula: C26H24ClFN2O4 MolecularWeight: 482.931163

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=CC(=NN2CC3=C(C=C(C=C3)F)Cl)C4=C(C=C(C=C4)OC)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=CC(=NN2CC3=C(C=C(C=C3)F)Cl)C4=C(C=C(C=C4)OC)OC)OC

InChI

InChI=1S/C26H24ClFN2O4/c1-31-18-7-9-20(25(12-18)33-3)23-14-24(21-10-8-19(32-2)13-26(21)34-4)30(29-23)15-16-5-6-17(28)11-22(16)27/h5-14H,15H2,1-4H3