4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-8-[(diethylazaniumyl)methyl]-2-oxidanylidene-chromen-7-olate

Systemtic Name: 4-(6-bromanyl-2-oxidanylidene-chromen-3-yl)-8-[(diethylazaniumyl)methyl]-2-oxidanylidene-chromen-7-olate Openeye Name: 4-(6-bromo-2-oxo-chromen-3-yl)-8-[(diethylammonio)methyl]-2-oxo-chromen-7-olate CAS Name: 4-(6-bromo-2-oxo-1-benzopyran-3-yl)-8-[(diethylammonio)methyl]-2-oxo-1-benzopyran-7-olate IUPAC Name: 4-(6-bromo-2-oxochromen-3-yl)-8-[(diethylazaniumyl)methyl]-2-oxochromen-7-olate Traditional Name: 4-(6-bromo-2-keto-chromen-3-yl)-8-[(diethylammonio)methyl]-2-keto-chromen-7-olate Formula: C23H20BrNO5 MolecularWeight: 470.3126

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C=CC2=C1OC(=O)C=C2C3=CC4=C(C=CC(=C4)Br)OC3=O)[O-]

Isomeric SMILES

CC[NH+](CC)CC1=C(C=CC2=C1OC(=O)C=C2C3=CC4=C(C=CC(=C4)Br)OC3=O)[O-]

InChI

InChI=1S/C23H20BrNO5/c1-3-25(4-2)12-18-19(26)7-6-15-16(11-21(27)30-22(15)18)17-10-13-9-14(24)5-8-20(13)29-23(17)28/h5-11,26H,3-4,12H2,1-2H3