(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-pyrrolidine

Systemtic Name: (2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-pyrrolidine Openeye Name: (2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-pyrrolidine CAS Name: (2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-[4-(1-pyrrolidinylsulfonyl)phenyl]sulfonylpyrrolidine IUPAC Name: (2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylpyrrolidine Traditional Name: (2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(4-pyrrolidinosulfonylphenyl)sulfonyl-pyrrolidine Formula: C23H28N2O6S2 MolecularWeight: 492.60822

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3C4=CC5=C(C=C4)OCCCO5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC[C@@H]3C4=CC5=C(C=C4)OCCCO5

InChI

InChI=1S/C23H28N2O6S2/c26-32(27,24-12-1-2-13-24)19-7-9-20(10-8-19)33(28,29)25-14-3-5-21(25)18-6-11-22-23(17-18)31-16-4-15-30-22/h6-11,17,21H,1-5,12-16H2/t21-/m1/s1