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

Systemtic Name: N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine; pentanoate Openeye Name: N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine; pentanoate CAS Name: N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]-1-propanamine; pentanoate IUPAC Name: N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine; pentanoate Traditional Name: methyl-[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amine; valerate Formula: C22H27F3NO3- MolecularWeight: 410.44989

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18F3NO.C5H10O2/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20;1-2-3-4-5(6)7/h2-10,16,21H,11-12H2,1H3;2-4H2,1H3,(H,6,7)/p-1