ethyl 3-methyl-8-oxidanyl-1-oxidanylidene-3,4-dihydroisochromene-7-carboxylate

Systemtic Name: ethyl 3-methyl-8-oxidanyl-1-oxidanylidene-3,4-dihydroisochromene-7-carboxylate Openeye Name: ethyl 8-hydroxy-3-methyl-1-oxo-isochromane-7-carboxylate CAS Name: 8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-carboxylic acid ethyl ester IUPAC Name: ethyl 8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carboxylate Traditional Name: 8-hydroxy-1-keto-3-methyl-isochroman-7-carboxylic acid ethyl ester Formula: C13H14O5 MolecularWeight: 250.24726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(CC(OC2=O)C)C=C1)O

Isomeric SMILES

CCOC(=O)C1=C(C2=C(CC(OC2=O)C)C=C1)O

InChI

InChI=1S/C13H14O5/c1-3-17-12(15)9-5-4-8-6-7(2)18-13(16)10(8)11(9)14/h4-5,7,14H,3,6H2,1-2H3