N-[1-[3-(3,5-dimethoxyphenyl)propanoyl]piperidin-4-yl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[1-[3-(3,5-dimethoxyphenyl)propanoyl]piperidin-4-yl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[1-[3-(3,5-dimethoxyphenyl)propanoyl]-4-piperidyl]-4-fluoro-benzenesulfonamide CAS Name: N-[1-[3-(3,5-dimethoxyphenyl)-1-oxopropyl]-4-piperidinyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[1-[3-(3,5-dimethoxyphenyl)propanoyl]piperidin-4-yl]-4-fluorobenzenesulfonamide Traditional Name: N-[1-[3-(3,5-dimethoxyphenyl)propanoyl]-4-piperidyl]-4-fluoro-benzenesulfonamide Formula: C22H27FN2O5S MolecularWeight: 450.523583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CCC(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CCC(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C22H27FN2O5S/c1-29-19-13-16(14-20(15-19)30-2)3-8-22(26)25-11-9-18(10-12-25)24-31(27,28)21-6-4-17(23)5-7-21/h4-7,13-15,18,24H,3,8-12H2,1-2H3