[3,5-bis(trifluoromethyl)phenyl]methyl 3-(oxan-4-ylamino)-1-propan-2-yl-cyclopentane-1-carboxylate

Systemtic Name: [3,5-bis(trifluoromethyl)phenyl]methyl 3-(oxan-4-ylamino)-1-propan-2-yl-cyclopentane-1-carboxylate Openeye Name: [3,5-bis(trifluoromethyl)phenyl]methyl 1-isopropyl-3-(tetrahydropyran-4-ylamino)cyclopentanecarboxylate CAS Name: 3-(4-oxanylamino)-1-propan-2-yl-1-cyclopentanecarboxylic acid [3,5-bis(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3,5-bis(trifluoromethyl)phenyl]methyl 3-(oxan-4-ylamino)-1-propan-2-ylcyclopentane-1-carboxylate Traditional Name: 1-isopropyl-3-(tetrahydropyran-4-ylamino)cyclopentanecarboxylic acid [3,5-bis(trifluoromethyl)benzyl] ester Formula: C23H29F6NO3 MolecularWeight: 481.471679

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(CCC(C1)NC2CCOCC2)C(=O)OCC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC(C)C1(CCC(C1)NC2CCOCC2)C(=O)OCC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C23H29F6NO3/c1-14(2)21(6-3-19(12-21)30-18-4-7-32-8-5-18)20(31)33-13-15-9-16(22(24,25)26)11-17(10-15)23(27,28)29/h9-11,14,18-19,30H,3-8,12-13H2,1-2H3