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

Systemtic Name: 6-[[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol Openeye Name: 6-[[4-[(5-chloro-2-thienyl)methyl]piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol CAS Name: 6-[[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazinyl]methyl]-1,3-benzodioxol-5-ol IUPAC Name: 6-[[4-[(5-chlorothiophen-2-yl)methyl]piperazin-1-yl]methyl]-1,3-benzodioxol-5-ol Traditional Name: 6-[[4-[(5-chloro-2-thienyl)methyl]piperazino]methyl]sesamol Formula: C17H19ClN2O3S MolecularWeight: 366.86236

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(S2)Cl)CC3=CC4=C(C=C3O)OCO4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(S2)Cl)CC3=CC4=C(C=C3O)OCO4

InChI

InChI=1S/C17H19ClN2O3S/c18-17-2-1-13(24-17)10-20-5-3-19(4-6-20)9-12-7-15-16(8-14(12)21)23-11-22-15/h1-2,7-8,21H,3-6,9-11H2