[6-(4-fluoranyl-3-methyl-phenyl)-2-oxidanidyl-3-(phenylmethyl)pyridazin-2-ium-4-yl]methanol

Systemtic Name: [6-(4-fluoranyl-3-methyl-phenyl)-2-oxidanidyl-3-(phenylmethyl)pyridazin-2-ium-4-yl]methanol Openeye Name: [3-benzyl-6-(4-fluoro-3-methyl-phenyl)-2-oxido-pyridazin-2-ium-4-yl]methanol CAS Name: [6-(4-fluoro-3-methylphenyl)-2-oxido-3-(phenylmethyl)-4-pyridazin-2-iumyl]methanol IUPAC Name: [3-benzyl-6-(4-fluoro-3-methylphenyl)-2-oxidopyridazin-2-ium-4-yl]methanol Traditional Name: [3-benzyl-6-(4-fluoro-3-methyl-phenyl)-2-oxido-pyridazin-2-ium-4-yl]methanol Formula: C19H17FN2O2 MolecularWeight: 324.348883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=N[N+](=C(C(=C2)CO)CC3=CC=CC=C3)[O-])F

Isomeric SMILES

CC1=C(C=CC(=C1)C2=N[N+](=C(C(=C2)CO)CC3=CC=CC=C3)[O-])F

InChI

InChI=1S/C19H17FN2O2/c1-13-9-15(7-8-17(13)20)18-11-16(12-23)19(22(24)21-18)10-14-5-3-2-4-6-14/h2-9,11,23H,10,12H2,1H3