cycloheptyl 3-ethyl-3-phenyl-6-[4-[[2-[4-(trifluoromethyl)phenyl]phenyl]carbonylamino]piperidin-1-yl]hexanoate

Systemtic Name: cycloheptyl 3-ethyl-3-phenyl-6-[4-[[2-[4-(trifluoromethyl)phenyl]phenyl]carbonylamino]piperidin-1-yl]hexanoate Openeye Name: cycloheptyl 3-ethyl-3-phenyl-6-[4-[[2-[4-(trifluoromethyl)phenyl]benzoyl]amino]-1-piperidyl]hexanoate CAS Name: 3-ethyl-6-[4-[[oxo-[2-[4-(trifluoromethyl)phenyl]phenyl]methyl]amino]-1-piperidinyl]-3-phenylhexanoic acid cycloheptyl ester IUPAC Name: cycloheptyl 3-ethyl-3-phenyl-6-[4-[[2-[4-(trifluoromethyl)phenyl]benzoyl]amino]piperidin-1-yl]hexanoate Traditional Name: 3-ethyl-3-phenyl-6-[4-[[2-[4-(trifluoromethyl)phenyl]benzoyl]amino]piperidino]hexanoic acid cycloheptyl ester Formula: C40H49F3N2O3 MolecularWeight: 662.82387

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCN1CCC(CC1)NC(=O)C2=CC=CC=C2C3=CC=C(C=C3)C(F)(F)F)(CC(=O)OC4CCCCCC4)C5=CC=CC=C5

Isomeric SMILES

CCC(CCCN1CCC(CC1)NC(=O)C2=CC=CC=C2C3=CC=C(C=C3)C(F)(F)F)(CC(=O)OC4CCCCCC4)C5=CC=CC=C5

InChI

InChI=1S/C40H49F3N2O3/c1-2-39(31-13-6-5-7-14-31,29-37(46)48-34-15-8-3-4-9-16-34)25-12-26-45-27-23-33(24-28-45)44-38(47)36-18-11-10-17-35(36)30-19-21-32(22-20-30)40(41,42)43/h5-7,10-11,13-14,17-22,33-34H,2-4,8-9,12,15-16,23-29H2,1H3,(H,44,47)