(2-butyl-1H-imidazol-5-yl)methyl-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]-(pyridin-4-ylmethyl)azanium

Systemtic Name: (2-butyl-1H-imidazol-5-yl)methyl-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]-(pyridin-4-ylmethyl)azanium Openeye Name: (2-butyl-1H-imidazol-5-yl)methyl-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]-(4-pyridylmethyl)ammonium CAS Name: (2-butyl-1H-imidazol-5-yl)methyl-[[1-(2-methoxyethyl)-4-piperidin-1-iumyl]methyl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: (2-butyl-1H-imidazol-5-yl)methyl-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]-(pyridin-4-ylmethyl)azanium Traditional Name: (2-butyl-1H-imidazol-5-yl)methyl-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]-(4-pyridylmethyl)ammonium Formula: C23H39N5O+2 MolecularWeight: 401.58866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1)C[NH+](CC2CC[NH+](CC2)CCOC)CC3=CC=NC=C3

Isomeric SMILES

CCCCC1=NC=C(N1)C[NH+](CC2CC[NH+](CC2)CCOC)CC3=CC=NC=C3

InChI

InChI=1S/C23H37N5O/c1-3-4-5-23-25-16-22(26-23)19-28(17-20-6-10-24-11-7-20)18-21-8-12-27(13-9-21)14-15-29-2/h6-7,10-11,16,21H,3-5,8-9,12-15,17-19H2,1-2H3,(H,25,26)/p+2