N-methyl-3-[4-[3-(trifluoromethyloxy)phenoxy]phenyl]propan-1-amine phosphate

Systemtic Name: N-methyl-3-[4-[3-(trifluoromethyloxy)phenoxy]phenyl]propan-1-amine phosphate Openeye Name: N-methyl-3-[4-[3-(trifluoromethoxy)phenoxy]phenyl]propan-1-amine phosphate CAS Name: N-methyl-3-[4-[3-(trifluoromethoxy)phenoxy]phenyl]-1-propanamine phosphate IUPAC Name: N-methyl-3-[4-[3-(trifluoromethoxy)phenoxy]phenyl]propan-1-amine phosphate Traditional Name: methyl-[3-[4-[3-(trifluoromethoxy)phenoxy]phenyl]propyl]amine phosphate Formula: C17H18F3NO6P-3 MolecularWeight: 420.296891

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCC1=CC=C(C=C1)OC2=CC(=CC=C2)OC(F)(F)F.[O-]P(=O)([O-])[O-]

Isomeric SMILES

CNCCCC1=CC=C(C=C1)OC2=CC(=CC=C2)OC(F)(F)F.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C17H18F3NO2.H3O4P/c1-21-11-3-4-13-7-9-14(10-8-13)22-15-5-2-6-16(12-15)23-17(18,19)20;1-5(2,3)4/h2,5-10,12,21H,3-4,11H2,1H3;(H3,1,2,3,4)/p-3