1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-(4-methylphenyl)sulfonyl-piperazine

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-(4-methylphenyl)sulfonyl-piperazine Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-(p-tolylsulfonyl)piperazine CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-(4-methylphenyl)sulfonylpiperazine IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-(4-methylphenyl)sulfonylpiperazine Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-tosyl-piperazine Formula: C20H24N2O6S2 MolecularWeight: 452.54436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C20H24N2O6S2/c1-16-3-5-17(6-4-16)29(23,24)21-9-11-22(12-10-21)30(25,26)18-7-8-19-20(15-18)28-14-2-13-27-19/h3-8,15H,2,9-14H2,1H3