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5-[4-[1-[methyl-[(3-propan-2-yloxyphenyl)methyl]amino]ethyl]phenyl]-1,2-oxazol-3-one; 2,2,2-tris(fluoranyl)ethanoic acid

5-[4-[1-[methyl-[(3-propan-2-yloxyphenyl)methyl]amino]ethyl]phenyl]-1,2-oxazol-3-one; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name:5-[4-[1-[methyl-[(3-propan-2-yloxyphenyl)methyl]amino]ethyl]phenyl]-1,2-oxazol-3-one; 2,2,2-tris(fluoranyl)ethanoic acid
Openeye Name:5-[4-[1-[(3-isopropoxyphenyl)methyl-methyl-amino]ethyl]phenyl]isoxazol-3-one; 2,2,2-trifluoroacetic acid
CAS Name:5-[4-[1-[methyl-[(3-propan-2-yloxyphenyl)methyl]amino]ethyl]phenyl]-3-isoxazolone; 2,2,2-trifluoroacetic acid
IUPAC Name:5-[4-[1-[methyl-[(3-propan-2-yloxyphenyl)methyl]amino]ethyl]phenyl]-1,2-oxazol-3-one; 2,2,2-trifluoroacetic acid
Traditional Name:5-[4-[1-[(3-isopropoxybenzyl)-methyl-amino]ethyl]phenyl]-4-isoxazolin-3-one; 2,2,2-trifluoroacetic acid
Formula: C24H27F3N2O5
MolecularWeight: 480.47679
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)CN(C)C(C)C2=CC=C(C=C2)C3=CC(=O)NO3.C(=O)(C(F)(F)F)O


Isomeric SMILES

CC(C)OC1=CC=CC(=C1)CN(C)C(C)C2=CC=C(C=C2)C3=CC(=O)NO3.C(=O)(C(F)(F)F)O


InChI

InChI=1S/C22H26N2O3.C2HF3O2/c1-15(2)26-20-7-5-6-17(12-20)14-24(4)16(3)18-8-10-19(11-9-18)21-13-22(25)23-27-21;3-2(4,5)1(6)7/h5-13,15-16H,14H2,1-4H3,(H,23,25);(H,6,7)


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