8-[(4-ethylpiperazin-4-ium-1-yl)methyl]-7-oxidanyl-3-phenyl-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 8-[(4-ethylpiperazin-4-ium-1-yl)methyl]-7-oxidanyl-3-phenyl-2-(trifluoromethyl)chromen-4-one Openeye Name: 8-[(4-ethylpiperazin-4-ium-1-yl)methyl]-7-hydroxy-3-phenyl-2-(trifluoromethyl)chromen-4-one CAS Name: 8-[(4-ethyl-1-piperazin-4-iumyl)methyl]-7-hydroxy-3-phenyl-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 8-[(4-ethylpiperazin-4-ium-1-yl)methyl]-7-hydroxy-3-phenyl-2-(trifluoromethyl)chromen-4-one Traditional Name: 8-[(4-ethylpiperazin-4-ium-1-yl)methyl]-7-hydroxy-3-phenyl-2-(trifluoromethyl)chromone Formula: C23H24F3N2O3+ MolecularWeight: 433.44347

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=C(C=CC3=C2OC(=C(C3=O)C4=CC=CC=C4)C(F)(F)F)O

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=C(C=CC3=C2OC(=C(C3=O)C4=CC=CC=C4)C(F)(F)F)O

InChI

InChI=1S/C23H23F3N2O3/c1-2-27-10-12-28(13-11-27)14-17-18(29)9-8-16-20(30)19(15-6-4-3-5-7-15)22(23(24,25)26)31-21(16)17/h3-9,29H,2,10-14H2,1H3/p+1