4-[4-[5-(3-carboxypyridin-4-yl)-7-methoxy-4-oxidanylidene-chromen-3-yl]phenyl]pyridine-3-carboxylic acid

Systemtic Name: 4-[4-[5-(3-carboxypyridin-4-yl)-7-methoxy-4-oxidanylidene-chromen-3-yl]phenyl]pyridine-3-carboxylic acid Openeye Name: 4-[4-[5-(3-carboxy-4-pyridyl)-7-methoxy-4-oxo-chromen-3-yl]phenyl]pyridine-3-carboxylic acid CAS Name: 4-[4-[5-(3-carboxy-4-pyridinyl)-7-methoxy-4-oxo-1-benzopyran-3-yl]phenyl]-3-pyridinecarboxylic acid IUPAC Name: 4-[4-[5-(3-carboxypyridin-4-yl)-7-methoxy-4-oxochromen-3-yl]phenyl]pyridine-3-carboxylic acid Traditional Name: 4-[4-[5-(3-carboxy-4-pyridyl)-4-keto-7-methoxy-chromen-3-yl]phenyl]nicotinic acid Formula: C28H18N2O7 MolecularWeight: 494.45172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C(=C1)C3=C(C=NC=C3)C(=O)O)C(=O)C(=CO2)C4=CC=C(C=C4)C5=C(C=NC=C5)C(=O)O

Isomeric SMILES

COC1=CC2=C(C(=C1)C3=C(C=NC=C3)C(=O)O)C(=O)C(=CO2)C4=CC=C(C=C4)C5=C(C=NC=C5)C(=O)O

InChI

InChI=1S/C28H18N2O7/c1-36-17-10-20(19-7-9-30-13-22(19)28(34)35)25-24(11-17)37-14-23(26(25)31)16-4-2-15(3-5-16)18-6-8-29-12-21(18)27(32)33/h2-14H,1H3,(H,32,33)(H,34,35)