(5-ethylfuran-2-yl)methyl-[[2-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridin-3-yl]methyl]azanium

Systemtic Name: (5-ethylfuran-2-yl)methyl-[[2-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridin-3-yl]methyl]azanium Openeye Name: (5-ethyl-2-furyl)methyl-[[2-(4-methyl-1,4-diazepan-4-ium-1-yl)-3-pyridyl]methyl]ammonium CAS Name: (5-ethyl-2-furanyl)methyl-[[2-(4-methyl-1,4-diazepan-4-ium-1-yl)-3-pyridinyl]methyl]ammonium IUPAC Name: (5-ethylfuran-2-yl)methyl-[[2-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridin-3-yl]methyl]azanium Traditional Name: (5-ethyl-2-furyl)methyl-[[2-(4-methyl-1,4-diazepan-4-ium-1-yl)-3-pyridyl]methyl]ammonium Formula: C19H30N4O+2 MolecularWeight: 330.4677

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(O1)C[NH2+]CC2=C(N=CC=C2)N3CCC[NH+](CC3)C

Isomeric SMILES

CCC1=CC=C(O1)C[NH2+]CC2=C(N=CC=C2)N3CCC[NH+](CC3)C

InChI

InChI=1S/C19H28N4O/c1-3-17-7-8-18(24-17)15-20-14-16-6-4-9-21-19(16)23-11-5-10-22(2)12-13-23/h4,6-9,20H,3,5,10-15H2,1-2H3/p+2