2,3-dihydro-1,4-benzodioxin-6-yl-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-yl-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-(4-tosylpiperazino)methanone Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H22N2O5S/c1-15-2-5-17(6-3-15)28(24,25)22-10-8-21(9-11-22)20(23)16-4-7-18-19(14-16)27-13-12-26-18/h2-7,14H,8-13H2,1H3