[3-(trifluoromethyl)phenyl]methyl 2-(1-adamantylcarbonylamino)ethanoate

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl 2-(1-adamantylcarbonylamino)ethanoate Openeye Name: [3-(trifluoromethyl)phenyl]methyl 2-(adamantane-1-carbonylamino)acetate CAS Name: 2-[[1-adamantyl(oxo)methyl]amino]acetic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl 2-(adamantane-1-carbonylamino)acetate Traditional Name: 2-(adamantane-1-carbonylamino)acetic acid [3-(trifluoromethyl)benzyl] ester Formula: C21H24F3NO3 MolecularWeight: 395.41537

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)OCC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)OCC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C21H24F3NO3/c22-21(23,24)17-3-1-2-13(7-17)12-28-18(26)11-25-19(27)20-8-14-4-15(9-20)6-16(5-14)10-20/h1-3,7,14-16H,4-6,8-12H2,(H,25,27)