S-[4-(4-fluorophenyl)carbonylpiperidin-1-yl] 6-oxidanyl-1,4-benzodioxine-2-carbothioate

Systemtic Name: S-[4-(4-fluorophenyl)carbonylpiperidin-1-yl] 6-oxidanyl-1,4-benzodioxine-2-carbothioate Openeye Name: S-[4-(4-fluorobenzoyl)-1-piperidyl] 6-hydroxy-1,4-benzodioxine-2-carbothioate CAS Name: 6-hydroxy-1,4-benzodioxin-2-carbothioic acid S-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl] ester IUPAC Name: S-[4-(4-fluorobenzoyl)piperidin-1-yl] 6-hydroxy-1,4-benzodioxine-2-carbothioate Traditional Name: 6-hydroxy-1,4-benzodioxin-2-carbothioic acid S-[4-(4-fluorobenzoyl)piperidino] ester Formula: C21H18FNO5S MolecularWeight: 415.434723

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC=C(C=C2)F)SC(=O)C3=COC4=C(O3)C=CC(=C4)O

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC=C(C=C2)F)SC(=O)C3=COC4=C(O3)C=CC(=C4)O

InChI

InChI=1S/C21H18FNO5S/c22-15-3-1-13(2-4-15)20(25)14-7-9-23(10-8-14)29-21(26)19-12-27-18-11-16(24)5-6-17(18)28-19/h1-6,11-12,14,24H,7-10H2