5,7-bis(oxidanyl)-2-[4-(2-pyridin-4-ylethynyl)phenyl]chromen-4-one

Systemtic Name: 5,7-bis(oxidanyl)-2-[4-(2-pyridin-4-ylethynyl)phenyl]chromen-4-one Openeye Name: 5,7-dihydroxy-2-[4-[2-(4-pyridyl)ethynyl]phenyl]chromen-4-one CAS Name: 5,7-dihydroxy-2-[4-(2-pyridin-4-ylethynyl)phenyl]-1-benzopyran-4-one IUPAC Name: 5,7-dihydroxy-2-[4-(2-pyridin-4-ylethynyl)phenyl]chromen-4-one Traditional Name: 5,7-dihydroxy-2-[4-[2-(4-pyridyl)ethynyl]phenyl]chromone Formula: C22H13NO4 MolecularWeight: 355.34292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CC2=CC=NC=C2)C3=CC(=O)C4=C(C=C(C=C4O3)O)O

Isomeric SMILES

C1=CC(=CC=C1C#CC2=CC=NC=C2)C3=CC(=O)C4=C(C=C(C=C4O3)O)O

InChI

InChI=1S/C22H13NO4/c24-17-11-18(25)22-19(26)13-20(27-21(22)12-17)16-5-3-14(4-6-16)1-2-15-7-9-23-10-8-15/h3-13,24-25H