5-[2-oxidanyl-3-(4-oxidanylidene-2-pyridin-4-yl-chromen-5-yl)oxy-propoxy]-2-pyridin-4-yl-chromen-4-one dihydrate

Systemtic Name: 5-[2-oxidanyl-3-(4-oxidanylidene-2-pyridin-4-yl-chromen-5-yl)oxy-propoxy]-2-pyridin-4-yl-chromen-4-one dihydrate Openeye Name: 5-[2-hydroxy-3-[4-oxo-2-(4-pyridyl)chromen-5-yl]oxy-propoxy]-2-(4-pyridyl)chromen-4-one dihydrate CAS Name: 5-[2-hydroxy-3-[(4-oxo-2-pyridin-4-yl-1-benzopyran-5-yl)oxy]propoxy]-2-pyridin-4-yl-1-benzopyran-4-one dihydrate IUPAC Name: 5-[2-hydroxy-3-(4-oxo-2-pyridin-4-ylchromen-5-yl)oxypropoxy]-2-pyridin-4-ylchromen-4-one dihydrate Traditional Name: 5-[2-hydroxy-3-[4-keto-2-(4-pyridyl)chromen-5-yl]oxy-propoxy]-2-(4-pyridyl)chromone dihydrate Formula: C31H26N2O9 MolecularWeight: 570.54614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)OCC(COC3=CC=CC4=C3C(=O)C=C(O4)C5=CC=NC=C5)O)C(=O)C=C(O2)C6=CC=NC=C6.O.O

Isomeric SMILES

C1=CC2=C(C(=C1)OCC(COC3=CC=CC4=C3C(=O)C=C(O4)C5=CC=NC=C5)O)C(=O)C=C(O2)C6=CC=NC=C6.O.O

InChI

InChI=1S/C31H22N2O7.2H2O/c34-21(17-37-24-3-1-5-26-30(24)22(35)15-28(39-26)19-7-11-32-12-8-19)18-38-25-4-2-6-27-31(25)23(36)16-29(40-27)20-9-13-33-14-10-20;;/h1-16,21,34H,17-18H2;2*1H2