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

Systemtic Name: 6-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]-1,3-benzodioxol-5-ol Openeye Name: 6-[[4-(2-naphthylsulfonyl)piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol CAS Name: 6-[[4-(2-naphthalenylsulfonyl)-1-piperazinyl]methyl]-1,3-benzodioxol-5-ol IUPAC Name: 6-[(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methyl]-1,3-benzodioxol-5-ol Traditional Name: 6-[[4-(2-naphthylsulfonyl)piperazino]methyl]sesamol Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2O)OCO3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2O)OCO3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C22H22N2O5S/c25-20-13-22-21(28-15-29-22)12-18(20)14-23-7-9-24(10-8-23)30(26,27)19-6-5-16-3-1-2-4-17(16)11-19/h1-6,11-13,25H,7-10,14-15H2