(5-chloranylpyridin-3-yl) 6-(butanoyloxymethyl)-2-oxidanylidene-chromene-3-carboxylate

Systemtic Name: (5-chloranylpyridin-3-yl) 6-(butanoyloxymethyl)-2-oxidanylidene-chromene-3-carboxylate Openeye Name: (5-chloro-3-pyridyl) 6-(butanoyloxymethyl)-2-oxo-chromene-3-carboxylate CAS Name: 2-oxo-6-(1-oxobutoxymethyl)-1-benzopyran-3-carboxylic acid (5-chloro-3-pyridinyl) ester IUPAC Name: (5-chloropyridin-3-yl) 6-(butanoyloxymethyl)-2-oxochromene-3-carboxylate Traditional Name: 6-(butyryloxymethyl)-2-keto-chromene-3-carboxylic acid (5-chloro-3-pyridyl) ester Formula: C20H16ClNO6 MolecularWeight: 401.79714

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC1=CC2=C(C=C1)OC(=O)C(=C2)C(=O)OC3=CC(=CN=C3)Cl

Isomeric SMILES

CCCC(=O)OCC1=CC2=C(C=C1)OC(=O)C(=C2)C(=O)OC3=CC(=CN=C3)Cl

InChI

InChI=1S/C20H16ClNO6/c1-2-3-18(23)26-11-12-4-5-17-13(6-12)7-16(20(25)28-17)19(24)27-15-8-14(21)9-22-10-15/h4-10H,2-3,11H2,1H3