8-[[2-(4-fluorophenyl)ethylazaniumyl]methyl]-4-(4-methoxyphenyl)-2-oxidanylidene-chromen-7-olate

Systemtic Name: 8-[[2-(4-fluorophenyl)ethylazaniumyl]methyl]-4-(4-methoxyphenyl)-2-oxidanylidene-chromen-7-olate Openeye Name: 8-[[2-(4-fluorophenyl)ethylammonio]methyl]-4-(4-methoxyphenyl)-2-oxo-chromen-7-olate CAS Name: 8-[[2-(4-fluorophenyl)ethylammonio]methyl]-4-(4-methoxyphenyl)-2-oxo-1-benzopyran-7-olate IUPAC Name: 8-[[2-(4-fluorophenyl)ethylazaniumyl]methyl]-4-(4-methoxyphenyl)-2-oxochromen-7-olate Traditional Name: 8-[[2-(4-fluorophenyl)ethylammonio]methyl]-2-keto-4-(4-methoxyphenyl)chromen-7-olate Formula: C25H22FNO4 MolecularWeight: 419.444883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=O)OC3=C2C=CC(=C3C[NH2+]CCC4=CC=C(C=C4)F)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=O)OC3=C2C=CC(=C3C[NH2+]CCC4=CC=C(C=C4)F)[O-]

InChI

InChI=1S/C25H22FNO4/c1-30-19-8-4-17(5-9-19)21-14-24(29)31-25-20(21)10-11-23(28)22(25)15-27-13-12-16-2-6-18(26)7-3-16/h2-11,14,27-28H,12-13,15H2,1H3