methyl 5,8-dimethyl-7-oxidanyl-3,4-dihydro-1H-isochromene-6-carboxylate

Systemtic Name: methyl 5,8-dimethyl-7-oxidanyl-3,4-dihydro-1H-isochromene-6-carboxylate Openeye Name: methyl 7-hydroxy-5,8-dimethyl-isochromane-6-carboxylate CAS Name: 7-hydroxy-5,8-dimethyl-3,4-dihydro-1H-2-benzopyran-6-carboxylic acid methyl ester IUPAC Name: methyl 7-hydroxy-5,8-dimethyl-3,4-dihydro-1H-isochromene-6-carboxylate Traditional Name: 7-hydroxy-5,8-dimethyl-isochroman-6-carboxylic acid methyl ester Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1CCOC2)C)O)C(=O)OC

Isomeric SMILES

CC1=C(C(=C(C2=C1CCOC2)C)O)C(=O)OC

InChI

InChI=1S/C13H16O4/c1-7-9-4-5-17-6-10(9)8(2)12(14)11(7)13(15)16-3/h14H,4-6H2,1-3H3