1-[3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[3-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazino]sulfonylphenyl]ethanone Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H24N2O5S/c1-16(24)18-3-2-4-19(14-18)29(25,26)23-9-7-22(8-10-23)15-17-5-6-20-21(13-17)28-12-11-27-20/h2-6,13-14H,7-12,15H2,1H3