3-[4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: 3-[4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]sulfonylbenzoate Openeye Name: 3-[[4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1-piperidyl]sulfonyl]benzoate CAS Name: 3-[[4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1-piperidinyl]sulfonyl]benzoate IUPAC Name: 3-[4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 3-[4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidino]sulfonylbenzoate Formula: C20H17FN3O5S- MolecularWeight: 430.429483

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=NO2)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CC(=C4)C(=O)[O-]

Isomeric SMILES

C1CN(CCC1C2=NC(=NO2)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CC(=C4)C(=O)[O-]

InChI

InChI=1S/C20H18FN3O5S/c21-16-6-4-13(5-7-16)18-22-19(29-23-18)14-8-10-24(11-9-14)30(27,28)17-3-1-2-15(12-17)20(25)26/h1-7,12,14H,8-11H2,(H,25,26)/p-1