N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]quinoxaline-2-carboxamide

Systemtic Name: N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]quinoxaline-2-carboxamide Openeye Name: N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]quinoxaline-2-carboxamide CAS Name: N-[[4-(4-methyl-1-piperazin-4-iumyl)phenyl]methyl]-2-quinoxalinecarboxamide IUPAC Name: N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]quinoxaline-2-carboxamide Traditional Name: N-[4-(4-methylpiperazin-4-ium-1-yl)benzyl]quinoxaline-2-carboxamide Formula: C21H24N5O+ MolecularWeight: 362.44816

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=C(C=C2)CNC(=O)C3=NC4=CC=CC=C4N=C3

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=C(C=C2)CNC(=O)C3=NC4=CC=CC=C4N=C3

InChI

InChI=1S/C21H23N5O/c1-25-10-12-26(13-11-25)17-8-6-16(7-9-17)14-23-21(27)20-15-22-18-4-2-3-5-19(18)24-20/h2-9,15H,10-14H2,1H3,(H,23,27)/p+1