3-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]sulfonylbenzenesulfonamide

Systemtic Name: 3-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]sulfonylbenzenesulfonamide Openeye Name: 3-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]sulfonylbenzenesulfonamide CAS Name: 3-[[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidinyl]sulfonyl]benzenesulfonamide IUPAC Name: 3-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]sulfonylbenzenesulfonamide Traditional Name: 3-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidino]sulfonylbenzenesulfonamide Formula: C18H20N2O6S2 MolecularWeight: 424.4912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)N)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1C[C@H](N(C1)S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)N)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C18H20N2O6S2/c19-27(21,22)14-3-1-4-15(12-14)28(23,24)20-8-2-5-16(20)13-6-7-17-18(11-13)26-10-9-25-17/h1,3-4,6-7,11-12,16H,2,5,8-10H2,(H2,19,21,22)/t16-/m0/s1