6-[[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol

Systemtic Name: 6-[[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol Openeye Name: 6-[(4-tetralin-6-ylsulfonylpiperazin-1-yl)methyl]-1,3-benzodioxol-5-ol CAS Name: 6-[[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-1-piperazinyl]methyl]-1,3-benzodioxol-5-ol IUPAC Name: 6-[[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol Traditional Name: 6-[(4-tetralin-6-ylsulfonylpiperazino)methyl]sesamol Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)CC4=CC5=C(C=C4O)OCO5

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)CC4=CC5=C(C=C4O)OCO5

InChI

InChI=1S/C22H26N2O5S/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/h5-6,11-13,25H,1-4,7-10,14-15H2