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

Systemtic Name: heptanoic acid; N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine Openeye Name: heptanoic acid; N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine CAS Name: heptanoic acid; N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]-1-propanamine IUPAC Name: heptanoic acid; N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine Traditional Name: enanthic acid; methyl-[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amine Formula: C24H32F3NO3 MolecularWeight: 439.51099

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)O.CNCCC(C1=CC=CC=C1)OC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCCCCCC(=O)O.CNCCC(C1=CC=CC=C1)OC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C17H18F3NO.C7H14O2/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(8)9/h2-10,16,21H,11-12H2,1H3;2-6H2,1H3,(H,8,9)