8-(morpholin-4-ium-4-ylmethyl)-7-oxidanyl-3-(2-propan-2-ylphenoxy)-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 8-(morpholin-4-ium-4-ylmethyl)-7-oxidanyl-3-(2-propan-2-ylphenoxy)-2-(trifluoromethyl)chromen-4-one Openeye Name: 7-hydroxy-3-(2-isopropylphenoxy)-8-(morpholin-4-ium-4-ylmethyl)-2-(trifluoromethyl)chromen-4-one CAS Name: 7-hydroxy-8-(4-morpholin-4-iumylmethyl)-3-(2-propan-2-ylphenoxy)-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 7-hydroxy-8-(morpholin-4-ium-4-ylmethyl)-3-(2-propan-2-ylphenoxy)-2-(trifluoromethyl)chromen-4-one Traditional Name: 7-hydroxy-3-(2-isopropylphenoxy)-8-(morpholin-4-ium-4-ylmethyl)-2-(trifluoromethyl)chromone Formula: C24H25F3NO5+ MolecularWeight: 464.45421

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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+]4CCOCC4)O)C(F)(F)F

Isomeric SMILES

CC(C)C1=CC=CC=C1OC2=C(OC3=C(C2=O)C=CC(=C3C[NH+]4CCOCC4)O)C(F)(F)F

InChI

InChI=1S/C24H24F3NO5/c1-14(2)15-5-3-4-6-19(15)32-22-20(30)16-7-8-18(29)17(13-28-9-11-31-12-10-28)21(16)33-23(22)24(25,26)27/h3-8,14,29H,9-13H2,1-2H3/p+1