1-(4-fluorophenyl)-3-[phenyl(pyridin-4-ylmethyl)amino]propan-1-one dihydrochloride

Systemtic Name: 1-(4-fluorophenyl)-3-[phenyl(pyridin-4-ylmethyl)amino]propan-1-one dihydrochloride Openeye Name: 1-(4-fluorophenyl)-3-[N-(4-pyridylmethyl)anilino]propan-1-one dihydrochloride CAS Name: 1-(4-fluorophenyl)-3-[N-(pyridin-4-ylmethyl)anilino]-1-propanone dihydrochloride IUPAC Name: 1-(4-fluorophenyl)-3-[N-(pyridin-4-ylmethyl)anilino]propan-1-one dihydrochloride Traditional Name: 1-(4-fluorophenyl)-3-[N-(4-pyridylmethyl)anilino]propan-1-one dihydrochloride Formula: C21H21Cl2FN2O MolecularWeight: 407.308643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC(=O)C2=CC=C(C=C2)F)CC3=CC=NC=C3.Cl.Cl

Isomeric SMILES

C1=CC=C(C=C1)N(CCC(=O)C2=CC=C(C=C2)F)CC3=CC=NC=C3.Cl.Cl

InChI

InChI=1S/C21H19FN2O.2ClH/c22-19-8-6-18(7-9-19)21(25)12-15-24(20-4-2-1-3-5-20)16-17-10-13-23-14-11-17;;/h1-11,13-14H,12,15-16H2;2*1H