1-[3-heptyl-2,4-bis(oxidanyl)phenyl]ethanone

Systemtic Name: 1-[3-heptyl-2,4-bis(oxidanyl)phenyl]ethanone Openeye Name: 1-(3-heptyl-2,4-dihydroxy-phenyl)ethanone CAS Name: 1-(3-heptyl-2,4-dihydroxyphenyl)ethanone IUPAC Name: 1-(3-heptyl-2,4-dihydroxyphenyl)ethanone Traditional Name: 1-(3-heptyl-2,4-dihydroxy-phenyl)ethanone Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(C=CC(=C1O)C(=O)C)O

Isomeric SMILES

CCCCCCCC1=C(C=CC(=C1O)C(=O)C)O

InChI

InChI=1S/C15H22O3/c1-3-4-5-6-7-8-13-14(17)10-9-12(11(2)16)15(13)18/h9-10,17-18H,3-8H2,1-2H3