1-(4-chlorophenyl)-N-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]cyclopropane-1-carboxamide

Systemtic Name: 1-(4-chlorophenyl)-N-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]cyclopropane-1-carboxamide Openeye Name: 1-(4-chlorophenyl)-N-[[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]methyl]cyclopropanecarboxamide CAS Name: 1-(4-chlorophenyl)-N-[[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]methyl]-1-cyclopropanecarboxamide IUPAC Name: 1-(4-chlorophenyl)-N-[[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]cyclopropane-1-carboxamide Traditional Name: 1-(4-chlorophenyl)-N-[[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]methyl]cyclopropanecarboxamide Formula: C21H26ClN4O+ MolecularWeight: 385.91034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN4O/c1-25-10-12-26(13-11-25)19-7-2-16(14-23-19)15-24-20(27)21(8-9-21)17-3-5-18(22)6-4-17/h2-7,14H,8-13,15H2,1H3,(H,24,27)/p+1