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1-[4-(phenylmethyl)piperazin-1-yl]-3-[(3R)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]propan-1-one
1-[4-(phenylmethyl)piperazin-1-yl]-3-[(3R)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]propan-1-one
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Descriptors Computed from Structure
Canonical SMILES:
C1CC(C[NH+](C1)CCCC2=CC=CC=C2)CCC(=O)N3CCN(CC3)CC4=CC=CC=C4
Isomeric SMILES
C1C[C@@H](C[NH+](C1)CCCC2=CC=CC=C2)CCC(=O)N3CCN(CC3)CC4=CC=CC=C4
InChI
InChI=1S/C28H39N3O/c32-28(31-21-19-30(20-22-31)23-26-11-5-2-6-12-26)16-15-27-14-8-18-29(24-27)17-7-13-25-9-3-1-4-10-25/h1-6,9-12,27H,7-8,13-24H2/p+1/t27-/m1/s1
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