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

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl-[(2-fluorophenyl)methyl]-methyl-azanium Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl-[(2-fluorophenyl)methyl]-methyl-ammonium CAS Name: (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl-[(2-fluorophenyl)methyl]-methylammonium IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl-[(2-fluorophenyl)methyl]-methylazanium Traditional Name: (7-ethyl-2-keto-chromen-4-yl)methyl-(2-fluorobenzyl)-methyl-ammonium Formula: C20H21FNO2+ MolecularWeight: 326.384643

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH+](C)CC3=CC=CC=C3F

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH+](C)CC3=CC=CC=C3F

InChI

InChI=1S/C20H20FNO2/c1-3-14-8-9-17-16(11-20(23)24-19(17)10-14)13-22(2)12-15-6-4-5-7-18(15)21/h4-11H,3,12-13H2,1-2H3/p+1