2-[[1-[3,5-bis(trifluoromethyl)phenyl]carbonyl-2-(phenylmethyl)piperidin-4-yl]amino]ethanoate

Systemtic Name: 2-[[1-[3,5-bis(trifluoromethyl)phenyl]carbonyl-2-(phenylmethyl)piperidin-4-yl]amino]ethanoate Openeye Name: 2-[[2-benzyl-1-[3,5-bis(trifluoromethyl)benzoyl]-4-piperidyl]amino]acetate CAS Name: 2-[[1-[[3,5-bis(trifluoromethyl)phenyl]-oxomethyl]-2-(phenylmethyl)-4-piperidinyl]amino]acetate IUPAC Name: 2-[[2-benzyl-1-[3,5-bis(trifluoromethyl)benzoyl]piperidin-4-yl]amino]acetate Traditional Name: 2-[[2-benzyl-1-[3,5-bis(trifluoromethyl)benzoyl]-4-piperidyl]amino]acetate Formula: C23H21F6N2O3- MolecularWeight: 487.414859

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC1NCC(=O)[O-])CC2=CC=CC=C2)C(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CN(C(CC1NCC(=O)[O-])CC2=CC=CC=C2)C(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C23H22F6N2O3/c24-22(25,26)16-9-15(10-17(11-16)23(27,28)29)21(34)31-7-6-18(30-13-20(32)33)12-19(31)8-14-4-2-1-3-5-14/h1-5,9-11,18-19,30H,6-8,12-13H2,(H,32,33)/p-1