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3-heptyl-6,8-bis(oxidanyl)-3,4-dihydro-1H-isochromene-7-carboxylic acid
3-heptyl-6,8-bis(oxidanyl)-3,4-dihydro-1H-isochromene-7-carboxylic acid
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Descriptors Computed from Structure
Canonical SMILES:
CCCCCCCC1CC2=CC(=C(C(=C2CO1)O)C(=O)O)O
Isomeric SMILES
CCCCCCCC1CC2=CC(=C(C(=C2CO1)O)C(=O)O)O
InChI
InChI=1S/C17H24O5/c1-2-3-4-5-6-7-12-8-11-9-14(18)15(17(20)21)16(19)13(11)10-22-12/h9,12,18-19H,2-8,10H2,1H3,(H,20,21)
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