N-(1,3-benzodioxol-5-ylmethyl)-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluoranyl-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluoranyl-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[(3,5-dimethyl-1-piperidyl)sulfonyl]-2-fluoro-benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-2-fluorobenzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluorobenzamide Traditional Name: 5-(3,5-dimethylpiperidino)sulfonyl-2-fluoro-N-piperonyl-benzamide Formula: C22H25FN2O5S MolecularWeight: 448.507703

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)NCC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)NCC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C22H25FN2O5S/c1-14-7-15(2)12-25(11-14)31(27,28)17-4-5-19(23)18(9-17)22(26)24-10-16-3-6-20-21(8-16)30-13-29-20/h3-6,8-9,14-15H,7,10-13H2,1-2H3,(H,24,26)