6-(hexanoyloxymethyl)-2-oxidanylidene-chromene-3-carboxylic acid

Systemtic Name: 6-(hexanoyloxymethyl)-2-oxidanylidene-chromene-3-carboxylic acid Openeye Name: 6-(hexanoyloxymethyl)-2-oxo-chromene-3-carboxylic acid CAS Name: 2-oxo-6-(1-oxohexoxymethyl)-1-benzopyran-3-carboxylic acid IUPAC Name: 6-(hexanoyloxymethyl)-2-oxochromene-3-carboxylic acid Traditional Name: 6-(caproyloxymethyl)-2-keto-chromene-3-carboxylic acid Formula: C17H18O6 MolecularWeight: 318.32122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OCC1=CC2=C(C=C1)OC(=O)C(=C2)C(=O)O

Isomeric SMILES

CCCCCC(=O)OCC1=CC2=C(C=C1)OC(=O)C(=C2)C(=O)O

InChI

InChI=1S/C17H18O6/c1-2-3-4-5-15(18)22-10-11-6-7-14-12(8-11)9-13(16(19)20)17(21)23-14/h6-9H,2-5,10H2,1H3,(H,19,20)