(4-methylphenyl) 4-(4-but-3-ynylphenyl)-3-fluoranyl-benzoate

Systemtic Name: (4-methylphenyl) 4-(4-but-3-ynylphenyl)-3-fluoranyl-benzoate Openeye Name: p-tolyl 4-(4-but-3-ynylphenyl)-3-fluoro-benzoate CAS Name: 4-(4-but-3-ynylphenyl)-3-fluorobenzoic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 4-(4-but-3-ynylphenyl)-3-fluorobenzoate Traditional Name: 4-(4-but-3-ynylphenyl)-3-fluoro-benzoic acid p-tolyl ester Formula: C24H19FO2 MolecularWeight: 358.404863

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H19FO2/c1-3-4-5-18-8-10-19(11-9-18)22-15-12-20(16-23(22)25)24(26)27-21-13-6-17(2)7-14-21/h1,6-16H,4-5H2,2H3