(1R,2R)-N-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]-2-phenyl-cyclopropane-1-carboxamide

Systemtic Name: (1R,2R)-N-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]-2-phenyl-cyclopropane-1-carboxamide Openeye Name: (1R,2R)-N-[[2-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]methyl]-2-phenyl-cyclopropanecarboxamide CAS Name: (1R,2R)-N-[[2-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]methyl]-2-phenyl-1-cyclopropanecarboxamide IUPAC Name: (1R,2R)-N-[[2-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]-2-phenylcyclopropane-1-carboxamide Traditional Name: (1R,2R)-N-[[2-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]methyl]-2-phenyl-cyclopropanecarboxamide Formula: C21H27N4O+ MolecularWeight: 351.46528

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=CC=N2)CNC(=O)C3CC3C4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=CC=N2)CNC(=O)[C@@H]3C[C@H]3C4=CC=CC=C4

InChI

InChI=1S/C21H26N4O/c1-24-10-12-25(13-11-24)20-17(8-5-9-22-20)15-23-21(26)19-14-18(19)16-6-3-2-4-7-16/h2-9,18-19H,10-15H2,1H3,(H,23,26)/p+1/t18-,19+/m0/s1