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2-[(2S)-4-(1,3-benzodioxol-4-ylmethyl)-1-methyl-piperazin-1-ium-2-yl]ethanol
2-[(2S)-4-(1,3-benzodioxol-4-ylmethyl)-1-methyl-piperazin-1-ium-2-yl]ethanol
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Descriptors Computed from Structure
Canonical SMILES:
C[NH+]1CCN(CC1CCO)CC2=C3C(=CC=C2)OCO3
Isomeric SMILES
C[NH+]1CCN(C[C@@H]1CCO)CC2=C3C(=CC=C2)OCO3
InChI
InChI=1S/C15H22N2O3/c1-16-6-7-17(10-13(16)5-8-18)9-12-3-2-4-14-15(12)20-11-19-14/h2-4,13,18H,5-11H2,1H3/p+1/t13-/m0/s1
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