4-(dimethylaminomethyl)-6-(4-fluoranyl-3-methyl-phenyl)-2-(phenylmethyl)pyridazin-3-one hydrochloride

Systemtic Name: 4-(dimethylaminomethyl)-6-(4-fluoranyl-3-methyl-phenyl)-2-(phenylmethyl)pyridazin-3-one hydrochloride Openeye Name: 2-benzyl-4-(dimethylaminomethyl)-6-(4-fluoro-3-methyl-phenyl)pyridazin-3-one hydrochloride CAS Name: 4-(dimethylaminomethyl)-6-(4-fluoro-3-methylphenyl)-2-(phenylmethyl)-3-pyridazinone hydrochloride IUPAC Name: 2-benzyl-4-(dimethylaminomethyl)-6-(4-fluoro-3-methylphenyl)pyridazin-3-one hydrochloride Traditional Name: 2-benzyl-4-(dimethylaminomethyl)-6-(4-fluoro-3-methyl-phenyl)pyridazin-3-one hydrochloride Formula: C21H23ClFN3O MolecularWeight: 387.878223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NN(C(=O)C(=C2)CN(C)C)CC3=CC=CC=C3)F.Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NN(C(=O)C(=C2)CN(C)C)CC3=CC=CC=C3)F.Cl

InChI

InChI=1S/C21H22FN3O.ClH/c1-15-11-17(9-10-19(15)22)20-12-18(14-24(2)3)21(26)25(23-20)13-16-7-5-4-6-8-16;/h4-12H,13-14H2,1-3H3;1H