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N-(phenylmethyl)-6-[3-(4-piperidin-1-ylphenyl)prop-2-ynoxy]hexan-1-amine
N-(phenylmethyl)-6-[3-(4-piperidin-1-ylphenyl)prop-2-ynoxy]hexan-1-amine
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Descriptors Computed from Structure
Canonical SMILES:
C1CCN(CC1)C2=CC=C(C=C2)C#CCOCCCCCCNCC3=CC=CC=C3
Isomeric SMILES
C1CCN(CC1)C2=CC=C(C=C2)C#CCOCCCCCCNCC3=CC=CC=C3
InChI
InChI=1S/C27H36N2O/c1(7-19-28-24-26-12-5-3-6-13-26)2-10-22-30-23-11-14-25-15-17-27(18-16-25)29-20-8-4-9-21-29/h3,5-6,12-13,15-18,28H,1-2,4,7-10,19-24H2
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