N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-ethyl-5-fluoranyl-2-methoxy-benzenesulfonamide

Systemtic Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-ethyl-5-fluoranyl-2-methoxy-benzenesulfonamide Openeye Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxo-ethyl]-N-ethyl-5-fluoro-2-methoxy-benzenesulfonamide CAS Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-oxoethyl]-N-ethyl-5-fluoro-2-methoxybenzenesulfonamide IUPAC Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl]-N-ethyl-5-fluoro-2-methoxybenzenesulfonamide Traditional Name: N-ethyl-5-fluoro-N-[2-keto-2-(4-piperonylpiperazino)ethyl]-2-methoxy-benzenesulfonamide Formula: C23H28FN3O6S MolecularWeight: 493.548323

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=C(C=CC(=C4)F)OC

Isomeric SMILES

CCN(CC(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=C(C=CC(=C4)F)OC

InChI

InChI=1S/C23H28FN3O6S/c1-3-27(34(29,30)22-13-18(24)5-7-20(22)31-2)15-23(28)26-10-8-25(9-11-26)14-17-4-6-19-21(12-17)33-16-32-19/h4-7,12-13H,3,8-11,14-16H2,1-2H3