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

Systemtic Name: 8-[(diethylazaniumyl)methyl]-4-oxidanylidene-3-(4-propoxycarbonylphenoxy)chromen-7-olate Openeye Name: 8-[(diethylammonio)methyl]-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate CAS Name: 8-[(diethylammonio)methyl]-4-oxo-3-[4-[oxo(propoxy)methyl]phenoxy]-1-benzopyran-7-olate IUPAC Name: 8-[(diethylazaniumyl)methyl]-4-oxo-3-(4-propoxycarbonylphenoxy)chromen-7-olate Traditional Name: 8-[(diethylammonio)methyl]-4-keto-3-(4-propoxycarbonylphenoxy)chromen-7-olate Formula: C24H27NO6 MolecularWeight: 425.47428

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3C[NH+](CC)CC)[O-]

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3C[NH+](CC)CC)[O-]

InChI

InChI=1S/C24H27NO6/c1-4-13-29-24(28)16-7-9-17(10-8-16)31-21-15-30-23-18(22(21)27)11-12-20(26)19(23)14-25(5-2)6-3/h7-12,15,26H,4-6,13-14H2,1-3H3