2,3-dihydro-1,4-benzodioxin-3-yl-(4-quinolin-8-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-3-yl-(4-quinolin-8-ylsulfonylpiperazin-1-yl)methanone Openeye Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-(8-quinolylsulfonyl)piperazin-1-yl]methanone CAS Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-(8-quinolinylsulfonyl)-1-piperazinyl]methanone IUPAC Name: 2,3-dihydro-1,4-benzodioxin-3-yl-(4-quinolin-8-ylsulfonylpiperazin-1-yl)methanone Traditional Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-(8-quinolylsulfonyl)piperazino]methanone Formula: C22H21N3O5S MolecularWeight: 439.48424

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2COC3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1CN(CCN1C(=O)C2COC3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C22H21N3O5S/c26-22(19-15-29-17-7-1-2-8-18(17)30-19)24-11-13-25(14-12-24)31(27,28)20-9-3-5-16-6-4-10-23-21(16)20/h1-10,19H,11-15H2