2-(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)ethanoate

Systemtic Name: 2-(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)ethanoate Openeye Name: 2-(6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)acetate CAS Name: 2-(6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)acetate IUPAC Name: 2-(6-ethyl-7-hydroxy-2-oxochromen-4-yl)acetate Traditional Name: 2-(6-ethyl-7-hydroxy-2-keto-chromen-4-yl)acetate Formula: C13H11O5- MolecularWeight: 247.22344

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CC(=O)[O-])O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CC(=O)[O-])O

InChI

InChI=1S/C13H12O5/c1-2-7-3-9-8(4-12(15)16)5-13(17)18-11(9)6-10(7)14/h3,5-6,14H,2,4H2,1H3,(H,15,16)/p-1