(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[2-(4-fluoranylphenoxy)ethyl]-methyl-azanium

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[2-(4-fluoranylphenoxy)ethyl]-methyl-azanium Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl-[2-(4-fluorophenoxy)ethyl]-methyl-ammonium CAS Name: (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-[2-(4-fluorophenoxy)ethyl]-methylammonium IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl-[2-(4-fluorophenoxy)ethyl]-methylazanium Traditional Name: 2-(4-fluorophenoxy)ethyl-[(2-keto-6,7-dimethyl-chromen-4-yl)methyl]-methyl-ammonium Formula: C21H23FNO3+ MolecularWeight: 356.410623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+](C)CCOC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+](C)CCOC3=CC=C(C=C3)F)C

InChI

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