methyl 2-(fluoranylmethyl)-4-(4-methylphenyl)-5-methylsulfonyl-benzoate

Systemtic Name: methyl 2-(fluoranylmethyl)-4-(4-methylphenyl)-5-methylsulfonyl-benzoate Openeye Name: methyl 2-(fluoromethyl)-5-methylsulfonyl-4-(p-tolyl)benzoate CAS Name: 2-(fluoromethyl)-4-(4-methylphenyl)-5-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 2-(fluoromethyl)-4-(4-methylphenyl)-5-methylsulfonylbenzoate Traditional Name: 2-(fluoromethyl)-5-mesyl-4-(p-tolyl)benzoic acid methyl ester Formula: C17H17FO4S MolecularWeight: 336.377883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=C(C=C2S(=O)(=O)C)C(=O)OC)CF

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=C(C=C2S(=O)(=O)C)C(=O)OC)CF

InChI

InChI=1S/C17H17FO4S/c1-11-4-6-12(7-5-11)14-8-13(10-18)15(17(19)22-2)9-16(14)23(3,20)21/h4-9H,10H2,1-3H3