N-butyl-N-methyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazo[1,2-a]pyridine-2-carboxamide

Systemtic Name: N-butyl-N-methyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazo[1,2-a]pyridine-2-carboxamide Openeye Name: N-butyl-N-methyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazo[1,2-a]pyridine-2-carboxamide CAS Name: N-butyl-N-methyl-3-[[4-(4-pyridin-1-iumyl)-1-piperazin-1-iumyl]methyl]-2-imidazo[1,2-a]pyridinecarboxamide IUPAC Name: N-butyl-N-methyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazo[1,2-a]pyridine-2-carboxamide Traditional Name: N-butyl-N-methyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazo[1,2-a]pyridine-2-carboxamide Formula: C23H32N6O+2 MolecularWeight: 408.53978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C1=C(N2C=CC=CC2=N1)C[NH+]3CCN(CC3)C4=CC=[NH+]C=C4

Isomeric SMILES

CCCCN(C)C(=O)C1=C(N2C=CC=CC2=N1)C[NH+]3CCN(CC3)C4=CC=[NH+]C=C4

InChI

InChI=1S/C23H30N6O/c1-3-4-12-26(2)23(30)22-20(29-13-6-5-7-21(29)25-22)18-27-14-16-28(17-15-27)19-8-10-24-11-9-19/h5-11,13H,3-4,12,14-18H2,1-2H3/p+2