cyclohexyl-[[3-(2-methoxyphenyl)-7-oxidanyl-4-oxidanylidene-2-(trifluoromethyl)chromen-8-yl]methyl]-methyl-azanium

Systemtic Name: cyclohexyl-[[3-(2-methoxyphenyl)-7-oxidanyl-4-oxidanylidene-2-(trifluoromethyl)chromen-8-yl]methyl]-methyl-azanium Openeye Name: cyclohexyl-[[7-hydroxy-3-(2-methoxyphenyl)-4-oxo-2-(trifluoromethyl)chromen-8-yl]methyl]-methyl-ammonium CAS Name: cyclohexyl-[[7-hydroxy-3-(2-methoxyphenyl)-4-oxo-2-(trifluoromethyl)-1-benzopyran-8-yl]methyl]-methylammonium IUPAC Name: cyclohexyl-[[7-hydroxy-3-(2-methoxyphenyl)-4-oxo-2-(trifluoromethyl)chromen-8-yl]methyl]-methylazanium Traditional Name: cyclohexyl-[[7-hydroxy-4-keto-3-(2-methoxyphenyl)-2-(trifluoromethyl)chromen-8-yl]methyl]-methyl-ammonium Formula: C25H27F3NO4+ MolecularWeight: 462.48139

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C=CC2=C1OC(=C(C2=O)C3=CC=CC=C3OC)C(F)(F)F)O)C4CCCCC4

Isomeric SMILES

C[NH+](CC1=C(C=CC2=C1OC(=C(C2=O)C3=CC=CC=C3OC)C(F)(F)F)O)C4CCCCC4

InChI

InChI=1S/C25H26F3NO4/c1-29(15-8-4-3-5-9-15)14-18-19(30)13-12-17-22(31)21(16-10-6-7-11-20(16)32-2)24(25(26,27)28)33-23(17)18/h6-7,10-13,15,30H,3-5,8-9,14H2,1-2H3/p+1