methyl 3,6-dimethyl-8-oxidanyl-1-oxidanylidene-isochromene-7-carboxylate

Systemtic Name: methyl 3,6-dimethyl-8-oxidanyl-1-oxidanylidene-isochromene-7-carboxylate Openeye Name: methyl 8-hydroxy-3,6-dimethyl-1-oxo-isochromene-7-carboxylate CAS Name: 8-hydroxy-3,6-dimethyl-1-oxo-2-benzopyran-7-carboxylic acid methyl ester IUPAC Name: methyl 8-hydroxy-3,6-dimethyl-1-oxoisochromene-7-carboxylate Traditional Name: 8-hydroxy-1-keto-3,6-dimethyl-isochromene-7-carboxylic acid methyl ester Formula: C13H12O5 MolecularWeight: 248.23138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(C(=C2C(=O)O1)O)C(=O)OC)C

Isomeric SMILES

CC1=CC2=CC(=C(C(=C2C(=O)O1)O)C(=O)OC)C

InChI

InChI=1S/C13H12O5/c1-6-4-8-5-7(2)18-13(16)10(8)11(14)9(6)12(15)17-3/h4-5,14H,1-3H3