cyclopropyl-[(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]-[[4-(trifluoromethyl)phenyl]methyl]azanium

Systemtic Name: cyclopropyl-[(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]-[[4-(trifluoromethyl)phenyl]methyl]azanium Openeye Name: cyclopropyl-[(7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl]-[[4-(trifluoromethyl)phenyl]methyl]ammonium CAS Name: cyclopropyl-[(7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl]-[[4-(trifluoromethyl)phenyl]methyl]ammonium IUPAC Name: cyclopropyl-[(7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl]-[[4-(trifluoromethyl)phenyl]methyl]azanium Traditional Name: cyclopropyl-[(7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl]-[4-(trifluoromethyl)benzyl]ammonium Formula: C22H21F3NO3+ MolecularWeight: 404.40225

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2C[NH+](CC3=CC=C(C=C3)C(F)(F)F)C4CC4)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2C[NH+](CC3=CC=C(C=C3)C(F)(F)F)C4CC4)O

InChI

InChI=1S/C22H20F3NO3/c1-13-19(27)9-8-18-15(10-20(28)29-21(13)18)12-26(17-6-7-17)11-14-2-4-16(5-3-14)22(23,24)25/h2-5,8-10,17,27H,6-7,11-12H2,1H3/p+1