3-[4-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonyl]piperazin-1-yl]sulfonylbenzenesulfonamide

Systemtic Name: 3-[4-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonyl]piperazin-1-yl]sulfonylbenzenesulfonamide Openeye Name: 3-[4-[(3R)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]piperazin-1-yl]sulfonylbenzenesulfonamide CAS Name: 3-[[4-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-oxomethyl]-1-piperazinyl]sulfonyl]benzenesulfonamide IUPAC Name: 3-[4-[(3R)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]piperazin-1-yl]sulfonylbenzenesulfonamide Traditional Name: 3-[4-[(3R)-2,3-dihydro-1,4-benzodioxin-3-carbonyl]piperazino]sulfonylbenzenesulfonamide Formula: C19H21N3O7S2 MolecularWeight: 467.51594

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2COC3=CC=CC=C3O2)S(=O)(=O)C4=CC(=CC=C4)S(=O)(=O)N

Isomeric SMILES

C1CN(CCN1C(=O)[C@H]2COC3=CC=CC=C3O2)S(=O)(=O)C4=CC(=CC=C4)S(=O)(=O)N

InChI

InChI=1S/C19H21N3O7S2/c20-30(24,25)14-4-3-5-15(12-14)31(26,27)22-10-8-21(9-11-22)19(23)18-13-28-16-6-1-2-7-17(16)29-18/h1-7,12,18H,8-11,13H2,(H2,20,24,25)/t18-/m1/s1