N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-methyl-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-methyl-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxo-ethyl]-N-methyl-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[2-[4-(4-fluorophenyl)-1-piperazinyl]-2-oxoethyl]-N-methyl-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl]-N-methyl-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[2-[4-(4-fluorophenyl)piperazino]-2-keto-ethyl]-N-methyl-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C21H24FN3O5S MolecularWeight: 449.495763

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCN(CC1)C2=CC=C(C=C2)F)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CN(CC(=O)N1CCN(CC1)C2=CC=C(C=C2)F)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H24FN3O5S/c1-23(31(27,28)18-6-7-19-20(14-18)30-13-12-29-19)15-21(26)25-10-8-24(9-11-25)17-4-2-16(22)3-5-17/h2-7,14H,8-13,15H2,1H3