(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl-[2-(4-fluoranylphenoxy)ethyl]-methyl-azanium

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl-[2-(4-fluoranylphenoxy)ethyl]-methyl-azanium Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl-[2-(4-fluorophenoxy)ethyl]-methyl-ammonium CAS Name: (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl-[2-(4-fluorophenoxy)ethyl]-methylammonium IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl-[2-(4-fluorophenoxy)ethyl]-methylazanium Traditional Name: (7-ethyl-2-keto-chromen-4-yl)methyl-[2-(4-fluorophenoxy)ethyl]-methyl-ammonium Formula: C21H23FNO3+ MolecularWeight: 356.410623

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH+](C)CCOC3=CC=C(C=C3)F

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH+](C)CCOC3=CC=C(C=C3)F

InChI

InChI=1S/C21H22FNO3/c1-3-15-4-9-19-16(13-21(24)26-20(19)12-15)14-23(2)10-11-25-18-7-5-17(22)6-8-18/h4-9,12-13H,3,10-11,14H2,1-2H3/p+1