heptan-2-yl 7-oxidanyl-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: heptan-2-yl 7-oxidanyl-4-oxidanylidene-chromene-2-carboxylate Openeye Name: 1-methylhexyl 7-hydroxy-4-oxo-chromene-2-carboxylate CAS Name: 7-hydroxy-4-oxo-1-benzopyran-2-carboxylic acid heptan-2-yl ester IUPAC Name: heptan-2-yl 7-hydroxy-4-oxochromene-2-carboxylate Traditional Name: 7-hydroxy-4-keto-chromene-2-carboxylic acid 1-methylhexyl ester Formula: C17H20O5 MolecularWeight: 304.3377

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)OC(=O)C1=CC(=O)C2=C(O1)C=C(C=C2)O

Isomeric SMILES

CCCCCC(C)OC(=O)C1=CC(=O)C2=C(O1)C=C(C=C2)O

InChI

InChI=1S/C17H20O5/c1-3-4-5-6-11(2)21-17(20)16-10-14(19)13-8-7-12(18)9-15(13)22-16/h7-11,18H,3-6H2,1-2H3