N-[2-(2-fluoranylphenoxy)ethyl]-N,6-dimethyl-2-propan-2-yl-pyrimidin-3-ium-4-amine

Systemtic Name: N-[2-(2-fluoranylphenoxy)ethyl]-N,6-dimethyl-2-propan-2-yl-pyrimidin-3-ium-4-amine Openeye Name: N-[2-(2-fluorophenoxy)ethyl]-2-isopropyl-N,6-dimethyl-pyrimidin-3-ium-4-amine CAS Name: N-[2-(2-fluorophenoxy)ethyl]-N,6-dimethyl-2-propan-2-yl-4-pyrimidin-3-iumamine IUPAC Name: N-[2-(2-fluorophenoxy)ethyl]-N,6-dimethyl-2-propan-2-ylpyrimidin-3-ium-4-amine Traditional Name: 2-(2-fluorophenoxy)ethyl-(2-isopropyl-6-methyl-pyrimidin-3-ium-4-yl)-methyl-amine Formula: C17H23FN3O+ MolecularWeight: 304.382423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=N1)C(C)C)N(C)CCOC2=CC=CC=C2F

Isomeric SMILES

CC1=CC(=[NH+]C(=N1)C(C)C)N(C)CCOC2=CC=CC=C2F

InChI

InChI=1S/C17H22FN3O/c1-12(2)17-19-13(3)11-16(20-17)21(4)9-10-22-15-8-6-5-7-14(15)18/h5-8,11-12H,9-10H2,1-4H3/p+1