N-methyl-3-naphthalen-1-yloxy-1-[3-(trifluoromethyl)phenyl]propan-1-amine sulfate

Systemtic Name: N-methyl-3-naphthalen-1-yloxy-1-[3-(trifluoromethyl)phenyl]propan-1-amine sulfate Openeye Name: N-methyl-3-(1-naphthyloxy)-1-[3-(trifluoromethyl)phenyl]propan-1-amine sulfate CAS Name: N-methyl-3-(1-naphthalenyloxy)-1-[3-(trifluoromethyl)phenyl]-1-propanamine sulfate IUPAC Name: N-methyl-3-naphthalen-1-yloxy-1-[3-(trifluoromethyl)phenyl]propan-1-amine sulfate Traditional Name: methyl-[3-(1-naphthoxy)-1-[3-(trifluoromethyl)phenyl]propyl]amine sulfate Formula: C21H20F3NO5S-2 MolecularWeight: 455.44741

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Descriptors Computed from Structure

Canonical SMILES:

CNC(CCOC1=CC=CC2=CC=CC=C21)C3=CC(=CC=C3)C(F)(F)F.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CNC(CCOC1=CC=CC2=CC=CC=C21)C3=CC(=CC=C3)C(F)(F)F.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C21H20F3NO.H2O4S/c1-25-19(16-8-4-9-17(14-16)21(22,23)24)12-13-26-20-11-5-7-15-6-2-3-10-18(15)20;1-5(2,3)4/h2-11,14,19,25H,12-13H2,1H3;(H2,1,2,3,4)/p-2