methyl (3R)-1-ethoxy-6,8-bis(oxidanyl)-3-pentyl-3,4-dihydro-1H-isochromene-7-carboxylate

Systemtic Name: methyl (3R)-1-ethoxy-6,8-bis(oxidanyl)-3-pentyl-3,4-dihydro-1H-isochromene-7-carboxylate Openeye Name: methyl (3R)-1-ethoxy-6,8-dihydroxy-3-pentyl-isochromane-7-carboxylate CAS Name: (3R)-1-ethoxy-6,8-dihydroxy-3-pentyl-3,4-dihydro-1H-2-benzopyran-7-carboxylic acid methyl ester IUPAC Name: methyl (3R)-1-ethoxy-6,8-dihydroxy-3-pentyl-3,4-dihydro-1H-isochromene-7-carboxylate Traditional Name: (3R)-3-amyl-1-ethoxy-6,8-dihydroxy-isochroman-7-carboxylic acid methyl ester Formula: C18H26O6 MolecularWeight: 338.39544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CC2=CC(=C(C(=C2C(O1)OCC)O)C(=O)OC)O

Isomeric SMILES

CCCCC[C@@H]1CC2=CC(=C(C(=C2C(O1)OCC)O)C(=O)OC)O

InChI

InChI=1S/C18H26O6/c1-4-6-7-8-12-9-11-10-13(19)15(17(21)22-3)16(20)14(11)18(24-12)23-5-2/h10,12,18-20H,4-9H2,1-3H3/t12-,18?/m1/s1