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

Systemtic Name: 1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-3,5-bis(3,4-dimethoxyphenyl)-4-methyl-pyrazole Openeye Name: 1-[(2-chloro-4-fluoro-phenyl)methyl]-3,5-bis(3,4-dimethoxyphenyl)-4-methyl-pyrazole CAS Name: 1-[(2-chloro-4-fluorophenyl)methyl]-3,5-bis(3,4-dimethoxyphenyl)-4-methylpyrazole IUPAC Name: 1-[(2-chloro-4-fluorophenyl)methyl]-3,5-bis(3,4-dimethoxyphenyl)-4-methylpyrazole Traditional Name: 1-(2-chloro-4-fluoro-benzyl)-3,5-bis(3,4-dimethoxyphenyl)-4-methyl-pyrazole Formula: C27H26ClFN2O4 MolecularWeight: 496.957743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C2=CC(=C(C=C2)OC)OC)CC3=C(C=C(C=C3)F)Cl)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=C(N(N=C1C2=CC(=C(C=C2)OC)OC)CC3=C(C=C(C=C3)F)Cl)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H26ClFN2O4/c1-16-26(17-7-10-22(32-2)24(12-17)34-4)30-31(15-19-6-9-20(29)14-21(19)28)27(16)18-8-11-23(33-3)25(13-18)35-5/h6-14H,15H2,1-5H3