N-(3-imidazol-1-ylpropyl)-6-[4-(4-pyridin-4-ylhexan-2-yl)pyridin-1-ium-1-yl]hexanamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-6-[4-(4-pyridin-4-ylhexan-2-yl)pyridin-1-ium-1-yl]hexanamide Openeye Name: N-(3-imidazol-1-ylpropyl)-6-[4-[1-methyl-3-(4-pyridyl)pentyl]pyridin-1-ium-1-yl]hexanamide CAS Name: N-[3-(1-imidazolyl)propyl]-6-[4-(4-pyridin-4-ylhexan-2-yl)-1-pyridin-1-iumyl]hexanamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-6-[4-(4-pyridin-4-ylhexan-2-yl)pyridin-1-ium-1-yl]hexanamide Traditional Name: N-(3-imidazol-1-ylpropyl)-6-[4-[1-methyl-3-(4-pyridyl)pentyl]pyridin-1-ium-1-yl]hexanamide Formula: C28H40N5O+ MolecularWeight: 462.6501

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)C1=CC=[N+](C=C1)CCCCCC(=O)NCCCN2C=CN=C2)C3=CC=NC=C3

Isomeric SMILES

CCC(CC(C)C1=CC=[N+](C=C1)CCCCCC(=O)NCCCN2C=CN=C2)C3=CC=NC=C3

InChI

InChI=1S/C28H39N5O/c1-3-25(27-9-14-29-15-10-27)22-24(2)26-11-19-32(20-12-26)17-6-4-5-8-28(34)31-13-7-18-33-21-16-30-23-33/h9-12,14-16,19-21,23-25H,3-8,13,17-18,22H2,1-2H3/p+1