tert-butylazanium; [3-(trifluoromethyl)phenyl] 2-methoxy-2-phenyl-ethanoate

Systemtic Name: tert-butylazanium; [3-(trifluoromethyl)phenyl] 2-methoxy-2-phenyl-ethanoate Openeye Name: tert-butylammonium; [3-(trifluoromethyl)phenyl] 2-methoxy-2-phenyl-acetate CAS Name: tert-butylammonium; 2-methoxy-2-phenylacetic acid [3-(trifluoromethyl)phenyl] ester IUPAC Name: tert-butylazanium; [3-(trifluoromethyl)phenyl] 2-methoxy-2-phenylacetate Traditional Name: tert-butylammonium; 2-methoxy-2-phenyl-acetic acid [3-(trifluoromethyl)phenyl] ester Formula: C20H25F3NO3+ MolecularWeight: 384.41261

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH3+].COC(C1=CC=CC=C1)C(=O)OC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC(C)(C)[NH3+].COC(C1=CC=CC=C1)C(=O)OC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C16H13F3O3.C4H11N/c1-21-14(11-6-3-2-4-7-11)15(20)22-13-9-5-8-12(10-13)16(17,18)19;1-4(2,3)5/h2-10,14H,1H3;5H2,1-3H3/p+1