1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3,5-bis(3,4-dimethoxyphenyl)-4-methyl-pyrazole

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3,5-bis(3,4-dimethoxyphenyl)-4-methyl-pyrazole Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methyl]-3,5-bis(3,4-dimethoxyphenyl)-4-methyl-pyrazole CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-3,5-bis(3,4-dimethoxyphenyl)-4-methylpyrazole IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methyl]-3,5-bis(3,4-dimethoxyphenyl)-4-methylpyrazole Traditional Name: 1-(2-chloro-6-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=CC=C3Cl)F)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=C(N(N=C1C2=CC(=C(C=C2)OC)OC)CC3=C(C=CC=C3Cl)F)C4=CC(=C(C=C4)OC)OC

InChI

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