4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]sulfonyl-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]sulfonyl-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]sulfonyl-N,N-diethyl-benzenesulfonamide CAS Name: 4-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]sulfonyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]sulfonyl-N,N-diethylbenzenesulfonamide Traditional Name: 4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]sulfonyl-N,N-diethyl-benzenesulfonamide Formula: C23H30N2O6S2 MolecularWeight: 494.6241

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C23H30N2O6S2/c1-3-24(4-2)32(26,27)19-9-11-20(12-10-19)33(28,29)25-14-5-7-21(25)18-8-13-22-23(17-18)31-16-6-15-30-22/h8-13,17,21H,3-7,14-16H2,1-2H3