ethyl 4-[[3-(4-ethoxycarbonylphenoxy)-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[3-(4-ethoxycarbonylphenoxy)-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[3-(4-ethoxycarbonylphenoxy)-7-hydroxy-4-oxo-chromen-8-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[3-(4-ethoxycarbonylphenoxy)-7-hydroxy-4-oxo-1-benzopyran-8-yl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-(4-ethoxycarbonylphenoxy)-7-hydroxy-4-oxochromen-8-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[3-(4-carbethoxyphenoxy)-7-hydroxy-4-keto-chromen-8-yl]methyl]piperazine-1-carboxylic acid ethyl ester Formula: C26H28N2O8 MolecularWeight: 496.50912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3CN4CCN(CC4)C(=O)OCC)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3CN4CCN(CC4)C(=O)OCC)O

InChI

InChI=1S/C26H28N2O8/c1-3-33-25(31)17-5-7-18(8-6-17)36-22-16-35-24-19(23(22)30)9-10-21(29)20(24)15-27-11-13-28(14-12-27)26(32)34-4-2/h5-10,16,29H,3-4,11-15H2,1-2H3