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N-[3-[4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]phenoxy]propyl]cyclohexanecarboxamide

N-[3-[4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]phenoxy]propyl]cyclohexanecarboxamide

Systemtic Name:N-[3-[4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]phenoxy]propyl]cyclohexanecarboxamide
Openeye Name:N-[3-[4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]phenoxy]propyl]cyclohexanecarboxamide
CAS Name:N-[3-[4-[[4-(2-pyridin-1-iumyl)-1-piperazin-1-iumyl]methyl]phenoxy]propyl]cyclohexanecarboxamide
IUPAC Name:N-[3-[4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]phenoxy]propyl]cyclohexanecarboxamide
Traditional Name:N-[3-[4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]phenoxy]propyl]cyclohexanecarboxamide
Formula: C26H38N4O2+2
MolecularWeight: 438.60552
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NCCCOC2=CC=C(C=C2)C[NH+]3CCN(CC3)C4=CC=CC=[NH+]4


Isomeric SMILES

C1CCC(CC1)C(=O)NCCCOC2=CC=C(C=C2)C[NH+]3CCN(CC3)C4=CC=CC=[NH+]4


InChI

InChI=1S/C26H36N4O2/c31-26(23-7-2-1-3-8-23)28-15-6-20-32-24-12-10-22(11-13-24)21-29-16-18-30(19-17-29)25-9-4-5-14-27-25/h4-5,9-14,23H,1-3,6-8,15-21H2,(H,28,31)/p+2


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