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6-chloranyl-3-hexyl-4-methyl-7-[(E)-3-phenylprop-2-enoxy]chromen-2-one
6-chloranyl-3-hexyl-4-methyl-7-[(E)-3-phenylprop-2-enoxy]chromen-2-one
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Descriptors Computed from Structure
Canonical SMILES:
CCCCCCC1=C(C2=CC(=C(C=C2OC1=O)OCC=CC3=CC=CC=C3)Cl)C
Isomeric SMILES
CCCCCCC1=C(C2=CC(=C(C=C2OC1=O)OC/C=C/C3=CC=CC=C3)Cl)C
InChI
InChI=1S/C25H27ClO3/c1-3-4-5-9-14-20-18(2)21-16-22(26)24(17-23(21)29-25(20)27)28-15-10-13-19-11-7-6-8-12-19/h6-8,10-13,16-17H,3-5,9,14-15H2,1-2H3/b13-10+
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