(4-methylphenyl) 4-[4-but-3-ynyl-2,3-bis(fluoranyl)phenyl]benzoate

Systemtic Name: (4-methylphenyl) 4-[4-but-3-ynyl-2,3-bis(fluoranyl)phenyl]benzoate Openeye Name: p-tolyl 4-(4-but-3-ynyl-2,3-difluoro-phenyl)benzoate CAS Name: 4-(4-but-3-ynyl-2,3-difluorophenyl)benzoic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 4-(4-but-3-ynyl-2,3-difluorophenyl)benzoate Traditional Name: 4-(4-but-3-ynyl-2,3-difluoro-phenyl)benzoic acid p-tolyl ester Formula: C24H18F2O2 MolecularWeight: 376.395326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H18F2O2/c1-3-4-5-18-12-15-21(23(26)22(18)25)17-8-10-19(11-9-17)24(27)28-20-13-6-16(2)7-14-20/h1,6-15H,4-5H2,2H3