[7-oxidanyl-4-oxidanylidene-3-(2-propan-2-ylphenoxy)-2-(trifluoromethyl)chromen-8-yl]methyl-bis(phenylmethyl)azanium

Systemtic Name: [7-oxidanyl-4-oxidanylidene-3-(2-propan-2-ylphenoxy)-2-(trifluoromethyl)chromen-8-yl]methyl-bis(phenylmethyl)azanium Openeye Name: dibenzyl-[[7-hydroxy-3-(2-isopropylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-8-yl]methyl]ammonium CAS Name: [7-hydroxy-4-oxo-3-(2-propan-2-ylphenoxy)-2-(trifluoromethyl)-1-benzopyran-8-yl]methyl-bis(phenylmethyl)ammonium IUPAC Name: dibenzyl-[[7-hydroxy-4-oxo-3-(2-propan-2-ylphenoxy)-2-(trifluoromethyl)chromen-8-yl]methyl]azanium Traditional Name: dibenzyl-[[7-hydroxy-3-(2-isopropylphenoxy)-4-keto-2-(trifluoromethyl)chromen-8-yl]methyl]ammonium Formula: C34H31F3NO4+ MolecularWeight: 574.60945

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OC2=C(OC3=C(C2=O)C=CC(=C3C[NH+](CC4=CC=CC=C4)CC5=CC=CC=C5)O)C(F)(F)F

Isomeric SMILES

CC(C)C1=CC=CC=C1OC2=C(OC3=C(C2=O)C=CC(=C3C[NH+](CC4=CC=CC=C4)CC5=CC=CC=C5)O)C(F)(F)F

InChI

InChI=1S/C34H30F3NO4/c1-22(2)25-15-9-10-16-29(25)41-32-30(40)26-17-18-28(39)27(31(26)42-33(32)34(35,36)37)21-38(19-23-11-5-3-6-12-23)20-24-13-7-4-8-14-24/h3-18,22,39H,19-21H2,1-2H3/p+1