6,8-bis[(diethylazaniumyl)methyl]-5-oxidanyl-4-oxidanylidene-2-phenyl-chromen-7-olate

Systemtic Name: 6,8-bis[(diethylazaniumyl)methyl]-5-oxidanyl-4-oxidanylidene-2-phenyl-chromen-7-olate Openeye Name: 6,8-bis[(diethylammonio)methyl]-5-hydroxy-4-oxo-2-phenyl-chromen-7-olate CAS Name: 6,8-bis[(diethylammonio)methyl]-5-hydroxy-4-oxo-2-phenyl-1-benzopyran-7-olate IUPAC Name: 6,8-bis[(diethylazaniumyl)methyl]-5-hydroxy-4-oxo-2-phenylchromen-7-olate Traditional Name: 6,8-bis[(diethylammonio)methyl]-5-hydroxy-4-keto-2-phenyl-chromen-7-olate Formula: C25H33N2O4+ MolecularWeight: 425.54052

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C2=C(C(=C1[O-])C[NH+](CC)CC)OC(=CC2=O)C3=CC=CC=C3)O

Isomeric SMILES

CC[NH+](CC)CC1=C(C2=C(C(=C1[O-])C[NH+](CC)CC)OC(=CC2=O)C3=CC=CC=C3)O

InChI

InChI=1S/C25H32N2O4/c1-5-26(6-2)15-18-23(29)19(16-27(7-3)8-4)25-22(24(18)30)20(28)14-21(31-25)17-12-10-9-11-13-17/h9-14,29-30H,5-8,15-16H2,1-4H3/p+1