[3-(4-ethoxycarbonylphenoxy)-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-diethyl-azanium

Systemtic Name: [3-(4-ethoxycarbonylphenoxy)-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-diethyl-azanium Openeye Name: [3-(4-ethoxycarbonylphenoxy)-7-hydroxy-4-oxo-chromen-8-yl]methyl-diethyl-ammonium CAS Name: [3-(4-ethoxycarbonylphenoxy)-7-hydroxy-4-oxo-1-benzopyran-8-yl]methyl-diethylammonium IUPAC Name: [3-(4-ethoxycarbonylphenoxy)-7-hydroxy-4-oxochromen-8-yl]methyl-diethylazanium Traditional Name: [3-(4-carbethoxyphenoxy)-7-hydroxy-4-keto-chromen-8-yl]methyl-diethyl-ammonium Formula: C23H26NO6+ MolecularWeight: 412.45564

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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)OCC)O

Isomeric SMILES

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

InChI

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