(1-methyl-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-[bis(fluoranyl)methoxy]benzoate

Systemtic Name: (1-methyl-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-[bis(fluoranyl)methoxy]benzoate Openeye Name: (1-methyl-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(difluoromethoxy)benzoate CAS Name: 4-(difluoromethoxy)benzoic acid (1-methyl-4-phenyl-1-cyclohexa-2,5-dienyl) ester IUPAC Name: (1-methyl-4-phenylcyclohexa-2,5-dien-1-yl) 4-(difluoromethoxy)benzoate Traditional Name: 4-(difluoromethoxy)benzoic acid (1-methyl-4-phenyl-cyclohexa-2,5-dien-1-yl) ester Formula: C21H18F2O3 MolecularWeight: 356.362626

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC(C=C1)C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)OC(F)F

Isomeric SMILES

CC1(C=CC(C=C1)C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)OC(F)F

InChI

InChI=1S/C21H18F2O3/c1-21(13-11-16(12-14-21)15-5-3-2-4-6-15)26-19(24)17-7-9-18(10-8-17)25-20(22)23/h2-14,16,20H,1H3