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

Systemtic Name: cyclohexyl 3-methyl-8-oxidanyl-1-oxidanylidene-3,4-dihydroisochromene-7-carboxylate Openeye Name: cyclohexyl 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 cyclohexyl ester IUPAC Name: cyclohexyl 8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carboxylate Traditional Name: 8-hydroxy-1-keto-3-methyl-isochroman-7-carboxylic acid cyclohexyl ester Formula: C17H20O5 MolecularWeight: 304.3377

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C(=C(C=C2)C(=O)OC3CCCCC3)O)C(=O)O1

Isomeric SMILES

CC1CC2=C(C(=C(C=C2)C(=O)OC3CCCCC3)O)C(=O)O1

InChI

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