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

Systemtic Name: 6,8-bis[(dimethylazaniumyl)methyl]-5-oxidanyl-4-oxidanylidene-2-phenyl-chromen-7-olate Openeye Name: 6,8-bis[(dimethylammonio)methyl]-5-hydroxy-4-oxo-2-phenyl-chromen-7-olate CAS Name: 6,8-bis[(dimethylammonio)methyl]-5-hydroxy-4-oxo-2-phenyl-1-benzopyran-7-olate IUPAC Name: 6,8-bis[(dimethylazaniumyl)methyl]-5-hydroxy-4-oxo-2-phenylchromen-7-olate Traditional Name: 6,8-bis[(dimethylammonio)methyl]-5-hydroxy-4-keto-2-phenyl-chromen-7-olate Formula: C21H25N2O4+ MolecularWeight: 369.4342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O4/c1-22(2)11-14-19(25)15(12-23(3)4)21-18(20(14)26)16(24)10-17(27-21)13-8-6-5-7-9-13/h5-10,25-26H,11-12H2,1-4H3/p+1