[4-[6-(2-methoxyethyl)-4-oxidanylidene-1H-pyrimidin-2-yl]phenyl]methyl-methyl-(pyridin-2-ylmethyl)azanium

Systemtic Name: [4-[6-(2-methoxyethyl)-4-oxidanylidene-1H-pyrimidin-2-yl]phenyl]methyl-methyl-(pyridin-2-ylmethyl)azanium Openeye Name: [4-[6-(2-methoxyethyl)-4-oxo-1H-pyrimidin-2-yl]phenyl]methyl-methyl-(2-pyridylmethyl)ammonium CAS Name: [4-[6-(2-methoxyethyl)-4-oxo-1H-pyrimidin-2-yl]phenyl]methyl-methyl-(2-pyridinylmethyl)ammonium IUPAC Name: [4-[6-(2-methoxyethyl)-4-oxo-1H-pyrimidin-2-yl]phenyl]methyl-methyl-(pyridin-2-ylmethyl)azanium Traditional Name: [4-[4-keto-6-(2-methoxyethyl)-1H-pyrimidin-2-yl]benzyl]-methyl-(2-pyridylmethyl)ammonium Formula: C21H25N4O2+ MolecularWeight: 365.4488

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)C2=NC(=O)C=C(N2)CCOC)CC3=CC=CC=N3

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)C2=NC(=O)C=C(N2)CCOC)CC3=CC=CC=N3

InChI

InChI=1S/C21H24N4O2/c1-25(15-19-5-3-4-11-22-19)14-16-6-8-17(9-7-16)21-23-18(10-12-27-2)13-20(26)24-21/h3-9,11,13H,10,12,14-15H2,1-2H3,(H,23,24,26)/p+1