[4-(4-fluorophenyl)-4-oxidanylidene-butyl] 2-chloranyl-5-methylsulfonyl-benzoate

Systemtic Name: [4-(4-fluorophenyl)-4-oxidanylidene-butyl] 2-chloranyl-5-methylsulfonyl-benzoate Openeye Name: [4-(4-fluorophenyl)-4-oxo-butyl] 2-chloro-5-methylsulfonyl-benzoate CAS Name: 2-chloro-5-methylsulfonylbenzoic acid [4-(4-fluorophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-fluorophenyl)-4-oxobutyl] 2-chloro-5-methylsulfonylbenzoate Traditional Name: 2-chloro-5-mesyl-benzoic acid [4-(4-fluorophenyl)-4-keto-butyl] ester Formula: C18H16ClFO5S MolecularWeight: 398.833043

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCCCC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCCCC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C18H16ClFO5S/c1-26(23,24)14-8-9-16(19)15(11-14)18(22)25-10-2-3-17(21)12-4-6-13(20)7-5-12/h4-9,11H,2-3,10H2,1H3