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

Systemtic Name: 6-[[4-(thiophen-2-ylmethyl)piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol Openeye Name: 6-[[4-(2-thienylmethyl)piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol CAS Name: 6-[[4-(thiophen-2-ylmethyl)-1-piperazinyl]methyl]-1,3-benzodioxol-5-ol IUPAC Name: 6-[[4-(thiophen-2-ylmethyl)piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol Traditional Name: 6-[[4-(2-thenyl)piperazino]methyl]sesamol Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CS2)CC3=CC4=C(C=C3O)OCO4

Isomeric SMILES

C1CN(CCN1CC2=CC=CS2)CC3=CC4=C(C=C3O)OCO4

InChI

InChI=1S/C17H20N2O3S/c20-15-9-17-16(21-12-22-17)8-13(15)10-18-3-5-19(6-4-18)11-14-2-1-7-23-14/h1-2,7-9,20H,3-6,10-12H2