butyl-ethyl-[[3-(4-ethylphenoxy)-7-oxidanyl-4-oxidanylidene-2-(trifluoromethyl)chromen-8-yl]methyl]azanium

Systemtic Name: butyl-ethyl-[[3-(4-ethylphenoxy)-7-oxidanyl-4-oxidanylidene-2-(trifluoromethyl)chromen-8-yl]methyl]azanium Openeye Name: butyl-ethyl-[[3-(4-ethylphenoxy)-7-hydroxy-4-oxo-2-(trifluoromethyl)chromen-8-yl]methyl]ammonium CAS Name: butyl-ethyl-[[3-(4-ethylphenoxy)-7-hydroxy-4-oxo-2-(trifluoromethyl)-1-benzopyran-8-yl]methyl]ammonium IUPAC Name: butyl-ethyl-[[3-(4-ethylphenoxy)-7-hydroxy-4-oxo-2-(trifluoromethyl)chromen-8-yl]methyl]azanium Traditional Name: butyl-ethyl-[[3-(4-ethylphenoxy)-7-hydroxy-4-keto-2-(trifluoromethyl)chromen-8-yl]methyl]ammonium Formula: C25H29F3NO4+ MolecularWeight: 464.49727

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC)CC1=C(C=CC2=C1OC(=C(C2=O)OC3=CC=C(C=C3)CC)C(F)(F)F)O

Isomeric SMILES

CCCC[NH+](CC)CC1=C(C=CC2=C1OC(=C(C2=O)OC3=CC=C(C=C3)CC)C(F)(F)F)O

InChI

InChI=1S/C25H28F3NO4/c1-4-7-14-29(6-3)15-19-20(30)13-12-18-21(31)23(24(25(26,27)28)33-22(18)19)32-17-10-8-16(5-2)9-11-17/h8-13,30H,4-7,14-15H2,1-3H3/p+1