N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-(4-fluorophenyl)sulfonyl-2-methyl-benzenesulfonamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-(4-fluorophenyl)sulfonyl-2-methyl-benzenesulfonamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-(4-fluorophenyl)sulfonyl-2-methyl-benzenesulfonamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-(4-fluorophenyl)sulfonyl-2-methylbenzenesulfonamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-(4-fluorophenyl)sulfonyl-2-methylbenzenesulfonamide Traditional Name: 5-(4-fluorophenyl)sulfonyl-N-homopiperonyl-2-methyl-benzenesulfonamide Formula: C22H20FNO6S2 MolecularWeight: 477.525703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)F)S(=O)(=O)NCCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)F)S(=O)(=O)NCCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H20FNO6S2/c1-15-2-6-19(31(25,26)18-7-4-17(23)5-8-18)13-22(15)32(27,28)24-11-10-16-3-9-20-21(12-16)30-14-29-20/h2-9,12-13,24H,10-11,14H2,1H3