3-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-2-[3,4,5-tris(oxidanyl)phenyl]chromen-4-one

Systemtic Name: 3-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-2-[3,4,5-tris(oxidanyl)phenyl]chromen-4-one Openeye Name: 3-[4-(2-pyridyl)piperazine-1-carbonyl]-2-(3,4,5-trihydroxyphenyl)chromen-4-one CAS Name: 3-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-2-(3,4,5-trihydroxyphenyl)-1-benzopyran-4-one IUPAC Name: 3-(4-pyridin-2-ylpiperazine-1-carbonyl)-2-(3,4,5-trihydroxyphenyl)chromen-4-one Traditional Name: 3-[4-(2-pyridyl)piperazine-1-carbonyl]-2-(3,4,5-trihydroxyphenyl)chromone Formula: C25H21N3O6 MolecularWeight: 459.45074

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=C(OC4=CC=CC=C4C3=O)C5=CC(=C(C(=C5)O)O)O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=C(OC4=CC=CC=C4C3=O)C5=CC(=C(C(=C5)O)O)O

InChI

InChI=1S/C25H21N3O6/c29-17-13-15(14-18(30)23(17)32)24-21(22(31)16-5-1-2-6-19(16)34-24)25(33)28-11-9-27(10-12-28)20-7-3-4-8-26-20/h1-8,13-14,29-30,32H,9-12H2