1-(1,3-benzodioxol-5-ylmethyl)-4-(4-piperidin-1-ylsulfonylphenyl)sulfonyl-piperazine

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-piperidin-1-ylsulfonylphenyl)sulfonyl-piperazine Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[4-(1-piperidylsulfonyl)phenyl]sulfonyl-piperazine CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[4-(1-piperidinylsulfonyl)phenyl]sulfonylpiperazine IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-piperidin-1-ylsulfonylphenyl)sulfonylpiperazine Traditional Name: 1-(4-piperidinosulfonylphenyl)sulfonyl-4-piperonyl-piperazine Formula: C23H29N3O6S2 MolecularWeight: 507.62286

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H29N3O6S2/c27-33(28,25-10-2-1-3-11-25)20-5-7-21(8-6-20)34(29,30)26-14-12-24(13-15-26)17-19-4-9-22-23(16-19)32-18-31-22/h4-9,16H,1-3,10-15,17-18H2