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1-(1,3-benzodioxol-5-ylmethyl)-4-[(3-methylphenyl)methyl]piperazin-4-ium
1-(1,3-benzodioxol-5-ylmethyl)-4-[(3-methylphenyl)methyl]piperazin-4-ium
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC(=CC=C1)C[NH+]2CCN(CC2)CC3=CC4=C(C=C3)OCO4
Isomeric SMILES
CC1=CC(=CC=C1)C[NH+]2CCN(CC2)CC3=CC4=C(C=C3)OCO4
InChI
InChI=1S/C20H24N2O2/c1-16-3-2-4-17(11-16)13-21-7-9-22(10-8-21)14-18-5-6-19-20(12-18)24-15-23-19/h2-6,11-12H,7-10,13-15H2,1H3/p+1
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