1-(6-bromanyl-1,3-benzodioxol-5-yl)-2-piperazin-1-yl-ethanol

Systemtic Name: 1-(6-bromanyl-1,3-benzodioxol-5-yl)-2-piperazin-1-yl-ethanol Openeye Name: 1-(6-bromo-1,3-benzodioxol-5-yl)-2-piperazin-1-yl-ethanol CAS Name: 1-(6-bromo-1,3-benzodioxol-5-yl)-2-(1-piperazinyl)ethanol IUPAC Name: 1-(6-bromo-1,3-benzodioxol-5-yl)-2-piperazin-1-ylethanol Traditional Name: 1-(6-bromo-1,3-benzodioxol-5-yl)-2-piperazino-ethanol Formula: C13H17BrN2O3 MolecularWeight: 329.18968

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC(C2=CC3=C(C=C2Br)OCO3)O

Isomeric SMILES

C1CN(CCN1)CC(C2=CC3=C(C=C2Br)OCO3)O

InChI

InChI=1S/C13H17BrN2O3/c14-10-6-13-12(18-8-19-13)5-9(10)11(17)7-16-3-1-15-2-4-16/h5-6,11,15,17H,1-4,7-8H2