N-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]-2-(4-phenylphenyl)ethanamide

Systemtic Name: N-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]-2-(4-phenylphenyl)ethanamide Openeye Name: N-[[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]methyl]-2-(4-phenylphenyl)acetamide CAS Name: N-[[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]methyl]-2-(4-phenylphenyl)acetamide IUPAC Name: N-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]-2-(4-phenylphenyl)acetamide Traditional Name: N-[[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]methyl]-2-(4-phenylphenyl)acetamide Formula: C25H29N4O+ MolecularWeight: 401.52396

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=C(C=C2)CNC(=O)CC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=C(C=C2)CNC(=O)CC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H28N4O/c1-28-13-15-29(16-14-28)24-12-9-21(18-26-24)19-27-25(30)17-20-7-10-23(11-8-20)22-5-3-2-4-6-22/h2-12,18H,13-17,19H2,1H3,(H,27,30)/p+1