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(2R)-3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]propane-1,2-diol
(2R)-3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]propane-1,2-diol
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Descriptors Computed from Structure
Canonical SMILES:
C1CN(CC[NH+]1CC2=CC3=C(C=C2)OCO3)CC(CO)O
Isomeric SMILES
C1CN(CC[NH+]1CC2=CC3=C(C=C2)OCO3)C[C@H](CO)O
InChI
InChI=1S/C15H22N2O4/c18-10-13(19)9-17-5-3-16(4-6-17)8-12-1-2-14-15(7-12)21-11-20-14/h1-2,7,13,18-19H,3-6,8-11H2/p+1/t13-/m1/s1
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