(E)-3-(3-fluorophenyl)-N-[2-(4-hydroxyphenyl)ethyl]-N-[[3-[2-(4-piperidin-1-ylpiperidin-1-yl)carbonylphenyl]phenyl]methyl]prop-2-enamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: (E)-3-(3-fluorophenyl)-N-[2-(4-hydroxyphenyl)ethyl]-N-[[3-[2-(4-piperidin-1-ylpiperidin-1-yl)carbonylphenyl]phenyl]methyl]prop-2-enamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: (E)-3-(3-fluorophenyl)-N-[2-(4-hydroxyphenyl)ethyl]-N-[[3-[2-[4-(1-piperidyl)piperidine-1-carbonyl]phenyl]phenyl]methyl]prop-2-enamide; 2,2,2-trifluoroacetic acid CAS Name: (E)-3-(3-fluorophenyl)-N-[2-(4-hydroxyphenyl)ethyl]-N-[[3-[2-[oxo-[4-(1-piperidinyl)-1-piperidinyl]methyl]phenyl]phenyl]methyl]-2-propenamide; 2,2,2-trifluoroacetic acid IUPAC Name: (E)-3-(3-fluorophenyl)-N-[2-(4-hydroxyphenyl)ethyl]-N-[[3-[2-(4-piperidin-1-ylpiperidine-1-carbonyl)phenyl]phenyl]methyl]prop-2-enamide; 2,2,2-trifluoroacetic acid Traditional Name: (E)-3-(3-fluorophenyl)-N-[2-(4-hydroxyphenyl)ethyl]-N-[3-[2-(4-piperidinopiperidine-1-carbonyl)phenyl]benzyl]acrylamide; 2,2,2-trifluoroacetic acid Formula: C43H45F4N3O5 MolecularWeight: 759.828113

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(CC2)C(=O)C3=CC=CC=C3C4=CC(=CC=C4)CN(CCC5=CC=C(C=C5)O)C(=O)C=CC6=CC(=CC=C6)F.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1CCN(CC1)C2CCN(CC2)C(=O)C3=CC=CC=C3C4=CC(=CC=C4)CN(CCC5=CC=C(C=C5)O)C(=O)/C=C/C6=CC(=CC=C6)F.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C41H44FN3O3.C2HF3O2/c42-35-11-7-8-32(29-35)16-19-40(47)45(25-20-31-14-17-37(46)18-15-31)30-33-9-6-10-34(28-33)38-12-2-3-13-39(38)41(48)44-26-21-36(22-27-44)43-23-4-1-5-24-43;3-2(4,5)1(6)7/h2-3,6-19,28-29,36,46H,1,4-5,20-27,30H2;(H,6,7)/b19-16+;