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

Systemtic Name: 8-[(diethylazaniumyl)methyl]-3-(4-methoxyphenyl)-4-oxidanylidene-chromen-7-olate Openeye Name: 8-[(diethylammonio)methyl]-3-(4-methoxyphenyl)-4-oxo-chromen-7-olate CAS Name: 8-[(diethylammonio)methyl]-3-(4-methoxyphenyl)-4-oxo-1-benzopyran-7-olate IUPAC Name: 8-[(diethylazaniumyl)methyl]-3-(4-methoxyphenyl)-4-oxochromen-7-olate Traditional Name: 8-[(diethylammonio)methyl]-4-keto-3-(4-methoxyphenyl)chromen-7-olate Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO4/c1-4-22(5-2)12-17-19(23)11-10-16-20(24)18(13-26-21(16)17)14-6-8-15(25-3)9-7-14/h6-11,13,23H,4-5,12H2,1-3H3