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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH3+].C1=CC=C(C=C1)OC(=O)COCC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CCCC[NH3+].C1=CC=C(C=C1)OC(=O)COCC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C16H13F3O3.C4H11N/c17-16(18,19)13-6-4-5-12(9-13)10-21-11-15(20)22-14-7-2-1-3-8-14;1-2-3-4-5/h1-9H,10-11H2;2-5H2,1H3/p+1