(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[2-(2-fluoranylphenoxy)ethyl]-methyl-azanium

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[2-(2-fluoranylphenoxy)ethyl]-methyl-azanium Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl-[2-(2-fluorophenoxy)ethyl]-methyl-ammonium CAS Name: (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-[2-(2-fluorophenoxy)ethyl]-methylammonium IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl-[2-(2-fluorophenoxy)ethyl]-methylazanium Traditional Name: 2-(2-fluorophenoxy)ethyl-[(2-keto-7,8-dimethyl-chromen-4-yl)methyl]-methyl-ammonium Formula: C21H23FNO3+ MolecularWeight: 356.410623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)C[NH+](C)CCOC3=CC=CC=C3F)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)C[NH+](C)CCOC3=CC=CC=C3F)C

InChI

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