8-[(diethylazaniumyl)methyl]-3-(4-methoxycarbonylphenoxy)-2-methyl-4-oxidanylidene-chromen-7-olate

Systemtic Name: 8-[(diethylazaniumyl)methyl]-3-(4-methoxycarbonylphenoxy)-2-methyl-4-oxidanylidene-chromen-7-olate Openeye Name: 8-[(diethylammonio)methyl]-3-(4-methoxycarbonylphenoxy)-2-methyl-4-oxo-chromen-7-olate CAS Name: 8-[(diethylammonio)methyl]-3-(4-methoxycarbonylphenoxy)-2-methyl-4-oxo-1-benzopyran-7-olate IUPAC Name: 8-[(diethylazaniumyl)methyl]-3-(4-methoxycarbonylphenoxy)-2-methyl-4-oxochromen-7-olate Traditional Name: 3-(4-carbomethoxyphenoxy)-8-[(diethylammonio)methyl]-4-keto-2-methyl-chromen-7-olate Formula: C23H25NO6 MolecularWeight: 411.4477

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C=CC2=C1OC(=C(C2=O)OC3=CC=C(C=C3)C(=O)OC)C)[O-]

Isomeric SMILES

CC[NH+](CC)CC1=C(C=CC2=C1OC(=C(C2=O)OC3=CC=C(C=C3)C(=O)OC)C)[O-]

InChI

InChI=1S/C23H25NO6/c1-5-24(6-2)13-18-19(25)12-11-17-20(26)21(14(3)29-22(17)18)30-16-9-7-15(8-10-16)23(27)28-4/h7-12,25H,5-6,13H2,1-4H3