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

Systemtic Name: N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine phosphate Openeye Name: N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine phosphate CAS Name: N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]-1-propanamine phosphate IUPAC Name: N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine phosphate Traditional Name: methyl-[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amine phosphate Formula: C17H18F3NO5P-3 MolecularWeight: 404.297491

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18F3NO.H3O4P/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20;1-5(2,3)4/h2-10,16,21H,11-12H2,1H3;(H3,1,2,3,4)/p-3