6-[[4-(2-phenylethenylsulfonyl)piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol

Systemtic Name: 6-[[4-(2-phenylethenylsulfonyl)piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol Openeye Name: 6-[(4-styrylsulfonylpiperazin-1-yl)methyl]-1,3-benzodioxol-5-ol CAS Name: 6-[[4-(2-phenylethenylsulfonyl)-1-piperazinyl]methyl]-1,3-benzodioxol-5-ol IUPAC Name: 6-[[4-(2-phenylethenylsulfonyl)piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol Traditional Name: 6-[(4-styrylsulfonylpiperazino)methyl]sesamol Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2O)OCO3)S(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2O)OCO3)S(=O)(=O)C=CC4=CC=CC=C4

InChI

InChI=1S/C20H22N2O5S/c23-18-13-20-19(26-15-27-20)12-17(18)14-21-7-9-22(10-8-21)28(24,25)11-6-16-4-2-1-3-5-16/h1-6,11-13,23H,7-10,14-15H2