furan-3-ylmethyl-methyl-[[4-(4-oxidanylidene-6-pyridin-2-yl-1H-pyrimidin-2-yl)phenyl]methyl]azanium

Systemtic Name: furan-3-ylmethyl-methyl-[[4-(4-oxidanylidene-6-pyridin-2-yl-1H-pyrimidin-2-yl)phenyl]methyl]azanium Openeye Name: 3-furylmethyl-methyl-[[4-[4-oxo-6-(2-pyridyl)-1H-pyrimidin-2-yl]phenyl]methyl]ammonium CAS Name: 3-furanylmethyl-methyl-[[4-[4-oxo-6-(2-pyridinyl)-1H-pyrimidin-2-yl]phenyl]methyl]ammonium IUPAC Name: furan-3-ylmethyl-methyl-[[4-(4-oxo-6-pyridin-2-yl-1H-pyrimidin-2-yl)phenyl]methyl]azanium Traditional Name: 3-furfuryl-[4-[4-keto-6-(2-pyridyl)-1H-pyrimidin-2-yl]benzyl]-methyl-ammonium Formula: C22H21N4O2+ MolecularWeight: 373.42774

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)C2=NC(=O)C=C(N2)C3=CC=CC=N3)CC4=COC=C4

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)C2=NC(=O)C=C(N2)C3=CC=CC=N3)CC4=COC=C4

InChI

InChI=1S/C22H20N4O2/c1-26(14-17-9-11-28-15-17)13-16-5-7-18(8-6-16)22-24-20(12-21(27)25-22)19-4-2-3-10-23-19/h2-12,15H,13-14H2,1H3,(H,24,25,27)/p+1